N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide

C19H23N3O — CID 18119444

IUPACN-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide
SMILESO=C(NCc1ccc(CN2CCCCC2)cc1)c1ccccn1
InChIInChI=1S/C19H23N3O/c23-19(18-6-2-3-11-20-18)21-14-16-7-9-17(10-8-16)15-22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-15H2,(H,21,23)
InChIKeyFRWNPANMDVBZKO-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.00
Rot. Bonds5

About N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide

N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide (PubChem CID 18119444) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide
PubChem CID18119444
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC NameN-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide
SMILESO=C(NCc1ccc(CN2CCCCC2)cc1)c1ccccn1
InChIInChI=1S/C19H23N3O/c23-19(18-6-2-3-11-20-18)21-14-16-7-9-17(10-8-16)15-22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-15H2,(H,21,23)
InChIKeyFRWNPANMDVBZKO-UHFFFAOYSA-N
XLogP3.00
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-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

4-(piperidin-1-ylmethyl)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]benzamide
CID 24654968
4-(piperidin-1-ylmethyl)-N-(pyridin-4-ylmethyl)benzamide
CID 17398321
N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]pyridine-2-carboxamide
CID 8588320
N-[[4-(azepan-1-ylmethyl)phenyl]methyl]-2-chloropyridine-4-carboxamide
CID 60602338
2,6-difluoro-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]benzamide
CID 51232553
N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]-1H-pyrazole-4-carboxamide
CID 122157149
N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide
CID 108743925
3-[[4-(azepan-1-ylmethyl)phenyl]methyl]-1-methyl-1-(1-pyridin-2-ylethyl)urea
CID 86867437
N-[4-(4-benzylpiperazin-1-yl)butyl]pyridine-2-carboxamide
CID 55932888
2-morpholin-4-yl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide
CID 25486327
N-[[4-(hydroxymethyl)phenyl]methyl]-4-(piperidin-1-ylmethyl)benzamide
CID 131952254
1-[4-(piperidin-1-ylmethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine
CID 83962786

Frequently Asked Questions

What is the IUPAC name of N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide?
The IUPAC name of N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide (CID 18119444) is N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide?
The canonical SMILES for N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide is O=C(NCc1ccc(CN2CCCCC2)cc1)c1ccccn1.
What is the InChIKey of N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide?
The InChIKey is FRWNPANMDVBZKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O/c23-19(18-6-2-3-11-20-18)21-14-16-7-9-17(10-8-16)15-22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-15H2,(H,21,23).
What are the key properties of N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide?
N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide has a molecular weight of 309.41 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide is sourced from PubChem (CID 18119444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).