1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine

C9H11N3 — CID 82415409

IUPAC1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine
SMILESCc1c(N)c2cccnc2n1C
InChIInChI=1S/C9H11N3/c1-6-8(10)7-4-3-5-11-9(7)12(6)2/h3-5H,10H2,1-2H3
InChIKeyCHMAZORPXJXQDK-UHFFFAOYSA-N
MW161.21 g/mol
LogP1.46
Rot. Bonds

About 1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine

1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine (PubChem CID 82415409) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is 1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine.

Molecular Properties

Compound Name1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine
PubChem CID82415409
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC Name1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine
SMILESCc1c(N)c2cccnc2n1C
InChIInChI=1S/C9H11N3/c1-6-8(10)7-4-3-5-11-9(7)12(6)2/h3-5H,10H2,1-2H3
InChIKeyCHMAZORPXJXQDK-UHFFFAOYSA-N
XLogP1.46
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-methylpyrido[2,3-b]indole
CID 12596580
ethane;9-methylpyrido[2,3-b]indole;propane
CID 171072564
4-hydroxy-1,3-dimethyl-1,8-naphthyridin-2-one
CID 54702806
5,7,9-trimethylpyrido[2,3-b]indole
CID 20672284
5-(1,2-dimethylpyrrolo[2,3-b]pyridin-3-yl)-1H-pyrrole-2-carboxylic acid
CID 163269618
(1-methyl-2-propan-2-ylpyrrolo[2,3-b]pyridin-3-yl)methanamine
CID 84671774
6-bromo-9-methylpyrido[2,3-b]indole
CID 19439810
4-methylpyrido[2,3-e][1,2,4]triazin-3-one
CID 59061424
3-chloro-1-methyl-2-phenylpyrrolo[2,3-b]pyridine
CID 146162317
1-methyl-3-propan-2-ylpyrido[2,3-d]pyrimidine-2,4-dione
CID 146615670
(2-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)methanamine
CID 84670204
4-imino-1,3-dimethylpyrido[2,3-d]pyrimidine-2-thione
CID 12730702

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine?
The IUPAC name of 1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine (CID 82415409) is 1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine.
What is the SMILES notation for 1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine?
The canonical SMILES for 1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine is Cc1c(N)c2cccnc2n1C.
What is the InChIKey of 1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine?
The InChIKey is CHMAZORPXJXQDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3/c1-6-8(10)7-4-3-5-11-9(7)12(6)2/h3-5H,10H2,1-2H3.
What are the key properties of 1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine?
1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine has a molecular weight of 161.21 g/mol, XLogP of 1.46, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine is sourced from PubChem (CID 82415409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).