2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine

C9H12N4 — CID 83874573

IUPAC2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine
SMILESCn1cnc2cc(CCN)cnc21
InChIInChI=1S/C9H12N4/c1-13-6-12-8-4-7(2-3-10)5-11-9(8)13/h4-6H,2-3,10H2,1H3
InChIKeyPKIURRPJMWIBNX-UHFFFAOYSA-N
MW176.22 g/mol
LogP0.47
Rot. Bonds2

About 2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine

2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine (PubChem CID 83874573) has the molecular formula C9H12N4 and a molecular weight of 176.22 g/mol. Its IUPAC name is 2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine.

Molecular Properties

Compound Name2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine
PubChem CID83874573
Molecular FormulaC9H12N4
Molecular Weight176.22 g/mol
Exact Mass176.11
IUPAC Name2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine
SMILESCn1cnc2cc(CCN)cnc21
InChIInChI=1S/C9H12N4/c1-13-6-12-8-4-7(2-3-10)5-11-9(8)13/h4-6H,2-3,10H2,1H3
InChIKeyPKIURRPJMWIBNX-UHFFFAOYSA-N
XLogP0.47
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2,2-dimethylpropyl)-3-methylimidazo[4,5-b]pyridine
CID 166010059
2-(2,3-dimethylimidazo[4,5-b]pyridin-6-yl)ethanamine
CID 83877519
2-(1-methylbenzimidazol-5-yl)ethanamine
CID 82255151
2-(1-methylpyrazolo[5,4-b]pyridin-5-yl)ethanamine
CID 19620145
(3-propan-2-ylimidazo[4,5-b]pyridin-6-yl)methanamine
CID 84662755
3-(7-bromo-1-methylbenzimidazol-5-yl)propan-1-amine
CID 83902839
2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine
CID 84651562
2-(7-chloro-1-propan-2-ylbenzimidazol-5-yl)ethanamine
CID 83897839
6-(dimethoxymethyl)-3-methylimidazo[4,5-b]pyridine
CID 46737968
methane;(1-methylbenzimidazol-5-yl)methanamine
CID 159204423
2-(5,6-dimethoxy-3-pyridinyl)ethanamine
CID 66847650
2-(1,5-dimethylimidazol-4-yl)ethanamine
CID 573597

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine?
The IUPAC name of 2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine (CID 83874573) is 2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine.
What is the SMILES notation for 2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine?
The canonical SMILES for 2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine is Cn1cnc2cc(CCN)cnc21.
What is the InChIKey of 2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine?
The InChIKey is PKIURRPJMWIBNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4/c1-13-6-12-8-4-7(2-3-10)5-11-9(8)13/h4-6H,2-3,10H2,1H3.
What are the key properties of 2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine?
2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine has a molecular weight of 176.22 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine is sourced from PubChem (CID 83874573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).