(3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide

C19H27N5O — CID 125442546

IUPAC(3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide
SMILESCc1cccn2c(CNC(=O)N3CC[C@H](N4CCCCC4)C3)cnc12
InChIInChI=1S/C19H27N5O/c1-15-6-5-10-24-17(12-20-18(15)24)13-21-19(25)23-11-7-16(14-23)22-8-3-2-4-9-22/h5-6,10,12,16H,2-4,7-9,11,13-14H2,1H3,(H,21,25)/t16-/m0/s1
InChIKeyOLSBZDGQVWWZIG-INIZCTEOSA-N
MW341.46 g/mol
LogP2.41
Rot. Bonds3

About (3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide

(3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide (PubChem CID 125442546) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is (3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide
PubChem CID125442546
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC Name(3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide
SMILESCc1cccn2c(CNC(=O)N3CC[C@H](N4CCCCC4)C3)cnc12
InChIInChI=1S/C19H27N5O/c1-15-6-5-10-24-17(12-20-18(15)24)13-21-19(25)23-11-7-16(14-23)22-8-3-2-4-9-22/h5-6,10,12,16H,2-4,7-9,11,13-14H2,1H3,(H,21,25)/t16-/m0/s1
InChIKeyOLSBZDGQVWWZIG-INIZCTEOSA-N
XLogP2.41
TPSA52.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-4-(pyrrolidine-1-carbonyl)piperidine-1-carboxamide
CID 122565100
(2R)-2-(hydroxymethyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidine-1-carboxamide
CID 125438910
2-(8-methylimidazo[1,2-a]pyridin-3-yl)-1-[4-(oxolan-3-yl)-1,4-diazepan-1-yl]ethanone
CID 166616819
1-[1-[2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one
CID 56880147
2-(8-methylimidazo[1,2-a]pyridin-3-yl)-1-[4-(thiolan-3-yl)-1,4-diazepan-1-yl]ethanone
CID 138806168
(3aR,6aR)-5-(cyclopropanecarbonyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-3a-carboxamide
CID 50974809
3-cyclopropyl-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]imidazo[4,5-b]pyridine-6-carboxamide
CID 176506052
(3R)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 95127546
(3R)-N-[(2-chloro-6-fluorophenyl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide
CID 125130031
N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-N'-(4-methylphenyl)propanediamide
CID 56738129
1-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid
CID 122040970
1-[cyclopropyl(pyridin-2-yl)methyl]-1-methyl-3-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea
CID 122560923

Frequently Asked Questions

What is the IUPAC name of (3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide?
The IUPAC name of (3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide (CID 125442546) is (3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide.
What is the SMILES notation for (3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide?
The canonical SMILES for (3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide is Cc1cccn2c(CNC(=O)N3CC[C@H](N4CCCCC4)C3)cnc12.
What is the InChIKey of (3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide?
The InChIKey is OLSBZDGQVWWZIG-INIZCTEOSA-N. The full InChI is InChI=1S/C19H27N5O/c1-15-6-5-10-24-17(12-20-18(15)24)13-21-19(25)23-11-7-16(14-23)22-8-3-2-4-9-22/h5-6,10,12,16H,2-4,7-9,11,13-14H2,1H3,(H,21,25)/t16-/m0/s1.
What are the key properties of (3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide?
(3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide has a molecular weight of 341.46 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide is sourced from PubChem (CID 125442546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).