Cas no 916172-85-5 (Benzenemethanamine, N,N-dimethyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yl)-)
![Benzenemethanamine, N,N-dimethyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yl)- structure](https://ossimg.kuujia.com/scimg/916500/916172-85-5x500.png)
916172-85-5 structure
Product Name:Benzenemethanamine, N,N-dimethyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yl)-
CAS No:916172-85-5
MF:C16H17N3
MW:251.326283216476
CID:1966842
PubChem ID:11998177
Update Time:2025-04-21
Benzenemethanamine, N,N-dimethyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanamine, N,N-dimethyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yl)-
- dimethyl-[3-(1H-pyrrolo[2,3-b]pyridin-4-yl)-benzyl]-amine
- SCHEMBL1718338
- DB-307847
- 916172-85-5
-
- Inchi： 1S/C16H17N3/c1-19(2)11-12-4-3-5-13(10-12)14-6-8-17-16-15(14)7-9-18-16/h3-10H,11H2,1-2H3,(H,17,18)
- InChI Key： DFOSXJAYPNNXPZ-UHFFFAOYSA-N
- SMILES： N(C)(C)CC1C=CC=C(C=1)C1C=CN=C2C=1C=CN2
Computed Properties
- Exact Mass: 251.142247555Da
- Monoisotopic Mass: 251.142247555Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 292
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 31.9?2
Benzenemethanamine, N,N-dimethyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yl)- Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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