(2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide

C20H26N4O — CID 95766087

IUPAC(2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide
SMILESCc1cn2c(n1)CC[C@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)C2
InChIInChI=1S/C20H26N4O/c1-15-12-24-14-17(9-10-19(24)21-15)22-20(25)18-8-5-11-23(18)13-16-6-3-2-4-7-16/h2-4,6-7,12,17-18H,5,8-11,13-14H2,1H3,(H,22,25)/t17-,18-/m0/s1
InChIKeyZCGYLBHHARZHRQ-ROUUACIJSA-N
MW338.45 g/mol
LogP2.29
Rot. Bonds4

About (2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide

(2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide (PubChem CID 95766087) has the molecular formula C20H26N4O and a molecular weight of 338.45 g/mol. Its IUPAC name is (2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide
PubChem CID95766087
Molecular FormulaC20H26N4O
Molecular Weight338.45 g/mol
Exact Mass338.21
IUPAC Name(2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide
SMILESCc1cn2c(n1)CC[C@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)C2
InChIInChI=1S/C20H26N4O/c1-15-12-24-14-17(9-10-19(24)21-15)22-20(25)18-8-5-11-23(18)13-16-6-3-2-4-7-16/h2-4,6-7,12,17-18H,5,8-11,13-14H2,1H3,(H,22,25)/t17-,18-/m0/s1
InChIKeyZCGYLBHHARZHRQ-ROUUACIJSA-N
XLogP2.29
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide 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

N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-phenylmethoxyacetamide
CID 95765808
2-(3-methylphenyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95788774
(3S)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2,3-dihydro-1-benzothiophene-3-carboxamide
CID 95771455
(2R)-1-(pyridin-4-ylmethyl)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]piperidine-2-carboxamide
CID 95760097
methyl 4-[(1-benzylpyrrolidine-2-carbonyl)amino]piperidine-1-carboxylate
CID 51093260
(2R)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 95765845
N-cyclopropyl-1-[(1-phenylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide
CID 78851425
1-benzyl-N-(2-methylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride
CID 120599716
1-benzyl-N-pyrrolidin-3-ylpiperidine-2-carboxamide
CID 119453078
(2S)-1-benzyl-N-(thian-4-yl)piperidine-2-carboxamide
CID 97215907
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-thiophen-2-ylacetamide
CID 86772548
2,3-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide
CID 95765797

Frequently Asked Questions

What is the IUPAC name of (2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide (CID 95766087) is (2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide is Cc1cn2c(n1)CC[C@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)C2.
What is the InChIKey of (2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide?
The InChIKey is ZCGYLBHHARZHRQ-ROUUACIJSA-N. The full InChI is InChI=1S/C20H26N4O/c1-15-12-24-14-17(9-10-19(24)21-15)22-20(25)18-8-5-11-23(18)13-16-6-3-2-4-7-16/h2-4,6-7,12,17-18H,5,8-11,13-14H2,1H3,(H,22,25)/t17-,18-/m0/s1.
What are the key properties of (2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide?
(2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide has a molecular weight of 338.45 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 95766087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).