N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide

C20H25N3O2 — CID 97314958

IUPACN-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide
SMILESCn1cc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)ccc1=O
InChIInChI=1S/C20H25N3O2/c1-22-15-18(9-10-19(22)24)20(25)21-12-17-8-5-11-23(14-17)13-16-6-3-2-4-7-16/h2-4,6-7,9-10,15,17H,5,8,11-14H2,1H3,(H,21,25)/t17-/m1/s1
InChIKeyAIKQPPMHOJXRSJ-QGZVFWFLSA-N
MW339.44 g/mol
LogP2.03
Rot. Bonds5

About N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide

N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide (PubChem CID 97314958) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide
PubChem CID97314958
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC NameN-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide
SMILESCn1cc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)ccc1=O
InChIInChI=1S/C20H25N3O2/c1-22-15-18(9-10-19(22)24)20(25)21-12-17-8-5-11-23(14-17)13-16-6-3-2-4-7-16/h2-4,6-7,9-10,15,17H,5,8,11-14H2,1H3,(H,21,25)/t17-/m1/s1
InChIKeyAIKQPPMHOJXRSJ-QGZVFWFLSA-N
XLogP2.03
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-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-[[(3S)-1-benzylpiperidin-3-yl]methyl]pyridine-4-carboxamide
CID 94779099
N-[(1-benzylpiperidin-3-yl)methyl]acetamide
CID 10444612
N-[(1-benzylpiperidin-3-yl)methyl]-3-methylpiperidine-1-carboxamide
CID 60597786
N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1,6-dimethyl-4-oxopyridine-2-carboxamide
CID 126446393
2-amino-N-[[(3S)-1-benzylpiperidin-3-yl]methyl]acetamide
CID 96553013
4-fluoro-N-[[(3S)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methyl]benzamide
CID 25289047
1-[(1-benzylpiperidin-3-yl)methyl]-3-phenylurea
CID 47081886
N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide
CID 42195132
3-amino-N-[(1-benzylpiperidin-3-yl)methyl]pyrazine-2-carboxamide
CID 71936440
N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-2-pyridin-3-ylpyrimidine-5-carboxamide
CID 97202083
N-[(1-benzylpiperidin-3-yl)methyl]-4-bromo-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 56562636
2-methoxy-N-[[(3R)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methyl]benzamide
CID 95222271

Frequently Asked Questions

What is the IUPAC name of N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide?
The IUPAC name of N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide (CID 97314958) is N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide is Cn1cc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)ccc1=O.
What is the InChIKey of N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide?
The InChIKey is AIKQPPMHOJXRSJ-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-22-15-18(9-10-19(22)24)20(25)21-12-17-8-5-11-23(14-17)13-16-6-3-2-4-7-16/h2-4,6-7,9-10,15,17H,5,8,11-14H2,1H3,(H,21,25)/t17-/m1/s1.
What are the key properties of N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide?
N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 97314958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).