N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide

C20H22N4O2 — CID 6625066

IUPACN-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
SMILESO=C(CCc1nc2cccnc2n1-c1ccccc1)NCC1CCCO1
InChIInChI=1S/C20H22N4O2/c25-19(22-14-16-8-5-13-26-16)11-10-18-23-17-9-4-12-21-20(17)24(18)15-6-2-1-3-7-15/h1-4,6-7,9,12,16H,5,8,10-11,13-14H2,(H,22,25)
InChIKeyOLOMKVKYFWFEAX-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.65
Rot. Bonds6

About N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide

N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide (PubChem CID 6625066) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
PubChem CID6625066
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC NameN-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
SMILESO=C(CCc1nc2cccnc2n1-c1ccccc1)NCC1CCCO1
InChIInChI=1S/C20H22N4O2/c25-19(22-14-16-8-5-13-26-16)11-10-18-23-17-9-4-12-21-20(17)24(18)15-6-2-1-3-7-15/h1-4,6-7,9,12,16H,5,8,10-11,13-14H2,(H,22,25)
InChIKeyOLOMKVKYFWFEAX-UHFFFAOYSA-N
XLogP2.65
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-benzyl-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 6622635
N-(3-methylbutyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 20867503
3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one
CID 6622705
N-(oxolan-2-ylmethyl)-2-(1-phenylbenzimidazol-2-yl)sulfanylacetamide
CID 2999669
N-(oxolan-2-ylmethyl)-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetamide
CID 2947527
3-(2-methyl-4-oxoquinazolin-3-yl)-N-[[(2R)-oxolan-2-yl]methyl]propanamide
CID 36994619
N-[[(2S)-oxolan-2-yl]methyl]-3-[3-oxo-4-(2-phenylethyl)quinoxalin-2-yl]propanamide
CID 8850288
N-[[(2S)-oxolan-2-yl]methyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 30822933
2-[3-(4-fluorophenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-(oxolan-2-ylmethyl)acetamide
CID 71841390
N'-[[(2S)-oxolan-2-yl]methyl]-N-(2-phenylethyl)butanediamide
CID 7303399
3-indolo[3,2-b]quinoxalin-6-yl-N-(oxolan-2-ylmethyl)propanamide
CID 108794711
N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide
CID 50806674

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide (CID 6625066) is N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide is O=C(CCc1nc2cccnc2n1-c1ccccc1)NCC1CCCO1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide?
The InChIKey is OLOMKVKYFWFEAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c25-19(22-14-16-8-5-13-26-16)11-10-18-23-17-9-4-12-21-20(17)24(18)15-6-2-1-3-7-15/h1-4,6-7,9,12,16H,5,8,10-11,13-14H2,(H,22,25).
What are the key properties of N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide?
N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide has a molecular weight of 350.42 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide is sourced from PubChem (CID 6625066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).