(1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine

C17H15FN6 — CID 58164226

IUPAC(1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine
SMILESN[C@H](Cc1cccc(F)c1)c1nc2ncc(-c3cn[nH]c3)cc2[nH]1
InChIInChI=1S/C17H15FN6/c18-13-3-1-2-10(4-13)5-14(19)16-23-15-6-11(7-20-17(15)24-16)12-8-21-22-9-12/h1-4,6-9,14H,5,19H2,(H,21,22)(H,20,23,24)/t14-/m1/s1
InChIKeyCYCMBYORWLJHQQ-CQSZACIVSA-N
MW322.35 g/mol
LogP2.73
Rot. Bonds4

About (1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine

(1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine (PubChem CID 58164226) has the molecular formula C17H15FN6 and a molecular weight of 322.35 g/mol. Its IUPAC name is (1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine.

Molecular Properties

Compound Name(1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine
PubChem CID58164226
Molecular FormulaC17H15FN6
Molecular Weight322.35 g/mol
Exact Mass322.13
IUPAC Name(1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine
SMILESN[C@H](Cc1cccc(F)c1)c1nc2ncc(-c3cn[nH]c3)cc2[nH]1
InChIInChI=1S/C17H15FN6/c18-13-3-1-2-10(4-13)5-14(19)16-23-15-6-11(7-20-17(15)24-16)12-8-21-22-9-12/h1-4,6-9,14H,5,19H2,(H,21,22)(H,20,23,24)/t14-/m1/s1
InChIKeyCYCMBYORWLJHQQ-CQSZACIVSA-N
XLogP2.73
TPSA96.27 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.35
LogP ≤ 52.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-fluorophenyl)-1-[6-(2-methoxy-4-pyridinyl)-1H-benzimidazol-2-yl]ethanamine
CID 77219863
2-[(1R)-1-amino-2-(3-fluorophenyl)ethyl]-8-methoxy-6-(1H-pyrazol-4-yl)-3H-quinazolin-4-one;bis(2,2,2-trifluoroacetic acid)
CID 136962238
(2R)-N-[2-acetamido-5-(1H-pyrazol-4-yl)phenyl]-2-amino-3-(3-fluorophenyl)propanamide
CID 117074618
2-[(1S)-1-amino-2-(3-methoxyphenyl)ethyl]-8-methoxy-6-(1H-pyrazol-4-yl)-3H-quinazolin-4-one
CID 135894316
2-[(1R)-1-amino-2-[3-(trifluoromethyl)phenyl]ethyl]-6-(1H-pyrazol-4-yl)-3H-quinazolin-4-one;bis(2,2,2-trifluoroacetic acid)
CID 136962194
(1R)-3-methyl-1-[6-(1H-pyrazol-4-yl)-1H-benzimidazol-2-yl]butan-1-amine
CID 130405228
2-(3-fluorophenyl)-1-pyridin-2-ylethanamine
CID 60819500
3-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)-5-(1H-pyrazol-4-yl)pyridin-2-amine
CID 44525868
2-(3-fluorophenyl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530243
2-(3-fluorophenyl)-1-phenylethanamine;hydrochloride
CID 25032833
3-(1H-pyrazol-4-yl)quinoline
CID 90943604
2-(3-fluorophenyl)-1-(3-methoxypyrazin-2-yl)ethanamine
CID 113421578

Frequently Asked Questions

What is the IUPAC name of (1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine?
The IUPAC name of (1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine (CID 58164226) is (1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine.
What is the SMILES notation for (1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine?
The canonical SMILES for (1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine is N[C@H](Cc1cccc(F)c1)c1nc2ncc(-c3cn[nH]c3)cc2[nH]1.
What is the InChIKey of (1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine?
The InChIKey is CYCMBYORWLJHQQ-CQSZACIVSA-N. The full InChI is InChI=1S/C17H15FN6/c18-13-3-1-2-10(4-13)5-14(19)16-23-15-6-11(7-20-17(15)24-16)12-8-21-22-9-12/h1-4,6-9,14H,5,19H2,(H,21,22)(H,20,23,24)/t14-/m1/s1.
What are the key properties of (1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine?
(1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine has a molecular weight of 322.35 g/mol, XLogP of 2.73, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-(3-fluorophenyl)-1-[6-(1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-yl]ethanamine is sourced from PubChem (CID 58164226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).