[3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol

C17H20N6O — CID 176741120

IUPAC[3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol
SMILESOCc1ccn2c(-c3ccnc(N[C@@H]4CCCNC4)n3)cnc2c1
InChIInChI=1S/C17H20N6O/c24-11-12-4-7-23-15(10-20-16(23)8-12)14-3-6-19-17(22-14)21-13-2-1-5-18-9-13/h3-4,6-8,10,13,18,24H,1-2,5,9,11H2,(H,19,21,22)/t13-/m1/s1
InChIKeyXKMSZUPWIHZVOT-CYBMUJFWSA-N
MW324.39 g/mol
LogP1.45
Rot. Bonds4

About [3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol

[3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol (PubChem CID 176741120) has the molecular formula C17H20N6O and a molecular weight of 324.39 g/mol. Its IUPAC name is [3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol.

Molecular Properties

Compound Name[3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol
PubChem CID176741120
Molecular FormulaC17H20N6O
Molecular Weight324.39 g/mol
Exact Mass324.17
IUPAC Name[3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol
SMILESOCc1ccn2c(-c3ccnc(N[C@@H]4CCCNC4)n3)cnc2c1
InChIInChI=1S/C17H20N6O/c24-11-12-4-7-23-15(10-20-16(23)8-12)14-3-6-19-17(22-14)21-13-2-1-5-18-9-13/h3-4,6-8,10,13,18,24H,1-2,5,9,11H2,(H,19,21,22)/t13-/m1/s1
InChIKeyXKMSZUPWIHZVOT-CYBMUJFWSA-N
XLogP1.45
TPSA87.37 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.39
LogP ≤ 51.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze [3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol with MolForge

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Related Compounds

ethane;2-[7-methoxy-3-[2-(piperidin-3-ylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol
CID 170591549
1,1,1-trifluoro-2-[7-methoxy-3-[2-(piperidin-3-ylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol
CID 167449935
ethane;1-[3-[2-(piperidin-3-ylamino)pyrimidin-4-yl]imidazo[1,2-a]pyrazin-6-yl]pyrrolidin-2-one
CID 167450026
4-(2-methylpyrazol-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-2-amine
CID 146989000
[3-[6-[[(3S,4S)-4-fluoropyrrolidin-3-yl]amino]pyrazin-2-yl]imidazo[1,2-a]pyridin-7-yl]methanol
CID 176741112
4-(7-cyclopropyloxyimidazo[1,2-a]pyridin-3-yl)-N-[(3S,4S)-4-fluoropyrrolidin-3-yl]pyrimidin-2-amine
CID 167449944
N-[(3S)-piperidin-3-yl]-4-pyridazin-4-ylpyrimidin-2-amine
CID 175699091
6-(7-fluoroimidazo[1,2-a]pyridin-3-yl)-N-[(3R)-piperidin-3-yl]pyrazin-2-amine
CID 58303229
1,1,1-trifluoro-2-[7-methoxy-3-[2-(pyrrolidin-3-ylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol
CID 167449985
4-cyclopropyl-N-piperidin-3-ylpyrimidin-2-amine
CID 83836771
6-[7-[(Z)-2-amino-1-hydrazinylethenyl]imidazo[1,2-a]pyridin-3-yl]-N-piperidin-3-ylpyridin-2-amine
CID 169129385
4-(5-pyrazol-1-yl-3-pyridinyl)-N-pyrrolidin-3-ylpyrimidin-2-amine
CID 167814770

Frequently Asked Questions

What is the IUPAC name of [3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol?
The IUPAC name of [3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol (CID 176741120) is [3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol.
What is the SMILES notation for [3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol?
The canonical SMILES for [3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol is OCc1ccn2c(-c3ccnc(N[C@@H]4CCCNC4)n3)cnc2c1.
What is the InChIKey of [3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol?
The InChIKey is XKMSZUPWIHZVOT-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H20N6O/c24-11-12-4-7-23-15(10-20-16(23)8-12)14-3-6-19-17(22-14)21-13-2-1-5-18-9-13/h3-4,6-8,10,13,18,24H,1-2,5,9,11H2,(H,19,21,22)/t13-/m1/s1.
What are the key properties of [3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol?
[3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol has a molecular weight of 324.39 g/mol, XLogP of 1.45, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2-[[(3R)-piperidin-3-yl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol is sourced from PubChem (CID 176741120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).