(2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide

C19H22N4O2 — CID 95291715

IUPAC(2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide
SMILESCc1cccn2cc(CN3CCC[C@H]3C(=O)NCc3ccco3)nc12
InChIInChI=1S/C19H22N4O2/c1-14-5-2-9-23-13-15(21-18(14)23)12-22-8-3-7-17(22)19(24)20-11-16-6-4-10-25-16/h2,4-6,9-10,13,17H,3,7-8,11-12H2,1H3,(H,20,24)/t17-/m0/s1
InChIKeyGMCNSSBYYKIVFW-KRWDZBQOSA-N
MW338.41 g/mol
LogP2.52
Rot. Bonds5

About (2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide

(2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide (PubChem CID 95291715) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is (2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide
PubChem CID95291715
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name(2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide
SMILESCc1cccn2cc(CN3CCC[C@H]3C(=O)NCc3ccco3)nc12
InChIInChI=1S/C19H22N4O2/c1-14-5-2-9-23-13-15(21-18(14)23)12-22-8-3-7-17(22)19(24)20-11-16-6-4-10-25-16/h2,4-6,9-10,13,17H,3,7-8,11-12H2,1H3,(H,20,24)/t17-/m0/s1
InChIKeyGMCNSSBYYKIVFW-KRWDZBQOSA-N
XLogP2.52
TPSA62.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 95627748
N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]cyclohexanecarboxamide
CID 3244515
1-[(2R)-2-[(2R)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]pyrrolidin-1-yl]ethanone
CID 98761952
1-[(2-cyclobutyl-1,3-thiazol-5-yl)methyl]-N-(furan-2-ylmethyl)pyrrolidine-2-carboxamide
CID 75438534
N-(furan-2-ylmethyl)-1-(2-hydroxybutyl)pyrrolidine-2-carboxamide
CID 111123272
(2S)-1-[(4-cyanophenyl)methyl]-N-(furan-2-ylmethyl)pyrrolidine-2-carboxamide
CID 38774108
(2R)-N-(furan-2-ylmethyl)-1-[2-(2-methylphenyl)acetyl]pyrrolidine-2-carboxamide
CID 95148543
N-(furan-2-ylmethyl)-1-(3-phenoxypropyl)pyrrolidine-2-carboxamide
CID 42885954
N-(furan-2-ylmethyl)-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]pyrrolidine-2-carboxamide
CID 55579042
N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-3-carboxamide
CID 119882742
N-(furan-2-ylmethyl)-1-[2-(4-methoxyanilino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 55578958
1-[2-[(1-acetylpiperidin-4-yl)amino]-2-oxoethyl]-N-(furan-2-ylmethyl)pyrrolidine-2-carboxamide
CID 78857324

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide (CID 95291715) is (2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide is Cc1cccn2cc(CN3CCC[C@H]3C(=O)NCc3ccco3)nc12.
What is the InChIKey of (2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is GMCNSSBYYKIVFW-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-14-5-2-9-23-13-15(21-18(14)23)12-22-8-3-7-17(22)19(24)20-11-16-6-4-10-25-16/h2,4-6,9-10,13,17H,3,7-8,11-12H2,1H3,(H,20,24)/t17-/m0/s1.
What are the key properties of (2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide?
(2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(furan-2-ylmethyl)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 95291715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).