3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine

C16H17FN4 — CID 82061556

IUPAC3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine
SMILESCc1cnc2c(c1)nc(-c1cccc(F)c1)n2CCCN
InChIInChI=1S/C16H17FN4/c1-11-8-14-16(19-10-11)21(7-3-6-18)15(20-14)12-4-2-5-13(17)9-12/h2,4-5,8-10H,3,6-7,18H2,1H3
InChIKeyOWWFVOSEUJQIPA-UHFFFAOYSA-N
MW284.34 g/mol
LogP2.89
Rot. Bonds4

About 3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine

3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine (PubChem CID 82061556) has the molecular formula C16H17FN4 and a molecular weight of 284.34 g/mol. Its IUPAC name is 3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine.

Molecular Properties

Compound Name3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine
PubChem CID82061556
Molecular FormulaC16H17FN4
Molecular Weight284.34 g/mol
Exact Mass284.14
IUPAC Name3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine
SMILESCc1cnc2c(c1)nc(-c1cccc(F)c1)n2CCCN
InChIInChI=1S/C16H17FN4/c1-11-8-14-16(19-10-11)21(7-3-6-18)15(20-14)12-4-2-5-13(17)9-12/h2,4-5,8-10H,3,6-7,18H2,1H3
InChIKeyOWWFVOSEUJQIPA-UHFFFAOYSA-N
XLogP2.89
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)propan-1-amine
CID 82061571
5-[8-(3-fluorophenyl)-2-[2-(2-fluorophenyl)ethyl]purin-9-yl]pentan-1-amine
CID 58155750
3-[6-methyl-2-(trifluoromethyl)imidazo[4,5-b]pyridin-3-yl]propan-1-amine
CID 82061574
2-(3-fluorophenyl)-6-methyl-3-(piperidin-3-ylmethyl)imidazo[4,5-b]pyridine
CID 82151111
3-[6-methyl-2-(3-phenoxypropyl)imidazo[4,5-b]pyridin-3-yl]propan-1-amine
CID 145420127
3-[(3-fluorophenyl)methyl]-6-methylimidazo[4,5-b]pyridin-2-amine
CID 79300822
3-(2-butyl-6-methylimidazo[4,5-b]pyridin-3-yl)propan-1-amine
CID 82061543
3-(6-methyl-2-phenylimidazo[4,5-b]pyridin-3-yl)propanoic acid
CID 82061511
2-[6-chloro-2-(3-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]acetic acid
CID 93209838
4-(6-methyl-2-propan-2-ylimidazo[4,5-b]pyridin-3-yl)butan-1-amine
CID 82061622
2-[2-(3,4-dimethylphenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]ethanol
CID 82150776
2-[6-chloro-2-(3-methylphenyl)imidazo[4,5-b]pyridin-3-yl]ethanol
CID 82150810

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine?
The IUPAC name of 3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine (CID 82061556) is 3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine.
What is the SMILES notation for 3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine?
The canonical SMILES for 3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine is Cc1cnc2c(c1)nc(-c1cccc(F)c1)n2CCCN.
What is the InChIKey of 3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine?
The InChIKey is OWWFVOSEUJQIPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN4/c1-11-8-14-16(19-10-11)21(7-3-6-18)15(20-14)12-4-2-5-13(17)9-12/h2,4-5,8-10H,3,6-7,18H2,1H3.
What are the key properties of 3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine?
3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine has a molecular weight of 284.34 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine is sourced from PubChem (CID 82061556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).