N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide

C19H23N3O — CID 109187875

IUPACN-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide
SMILESCC1CCCN(c2ccc(C(=O)NCc3ccccc3)nc2)C1
InChIInChI=1S/C19H23N3O/c1-15-6-5-11-22(14-15)17-9-10-18(20-13-17)19(23)21-12-16-7-3-2-4-8-16/h2-4,7-10,13,15H,5-6,11-12,14H2,1H3,(H,21,23)
InChIKeyOQNQDHCVKYLCPB-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.25
Rot. Bonds4

About N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide

N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide (PubChem CID 109187875) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide
PubChem CID109187875
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC NameN-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide
SMILESCC1CCCN(c2ccc(C(=O)NCc3ccccc3)nc2)C1
InChIInChI=1S/C19H23N3O/c1-15-6-5-11-22(14-15)17-9-10-18(20-13-17)19(23)21-12-16-7-3-2-4-8-16/h2-4,7-10,13,15H,5-6,11-12,14H2,1H3,(H,21,23)
InChIKeyOQNQDHCVKYLCPB-UHFFFAOYSA-N
XLogP3.25
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methoxyphenyl)methyl]-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide
CID 109190182
N-benzyl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109117891
N-cyclohexyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide
CID 109182975
N-[(4-chlorophenyl)methyl]-4-(3-methylpiperidin-1-yl)pyridine-2-carboxamide
CID 109211807
N-benzyl-5-[4-(4-fluorophenyl)piperazin-1-yl]pyridine-2-carboxamide
CID 109187850
5-(3-methylpiperidin-1-yl)-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide
CID 109283250
1-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]-3-phenylurea
CID 56923040
2-(2-fluorophenyl)-N-[[4-[(3S)-3-methylpiperidin-1-yl]phenyl]methyl]acetamide
CID 100637147
N-[[4-[(3R)-3-methylpiperidin-1-yl]phenyl]methyl]cyclopropanecarboxamide
CID 100610781
N-(3,4-difluorophenyl)-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide
CID 109196527
N-[(4-chlorophenyl)methyl]-2-(3-methylpiperidin-1-yl)pyrimidine-5-carboxamide
CID 109257604
N-(5-chloro-2-methylphenyl)-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide
CID 109196455

Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide (CID 109187875) is N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide is CC1CCCN(c2ccc(C(=O)NCc3ccccc3)nc2)C1.
What is the InChIKey of N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide?
The InChIKey is OQNQDHCVKYLCPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O/c1-15-6-5-11-22(14-15)17-9-10-18(20-13-17)19(23)21-12-16-7-3-2-4-8-16/h2-4,7-10,13,15H,5-6,11-12,14H2,1H3,(H,21,23).
What are the key properties of N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide?
N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide has a molecular weight of 309.41 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 109187875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).