N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide

C16H25N3O — CID 63130322

IUPACN-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
SMILESCCCC1(C(=O)N(C)Cc2ccccn2)CCCNC1
InChIInChI=1S/C16H25N3O/c1-3-8-16(9-6-10-17-13-16)15(20)19(2)12-14-7-4-5-11-18-14/h4-5,7,11,17H,3,6,8-10,12-13H2,1-2H3
InChIKeyNBIMKTVSPCDHOO-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.21
Rot. Bonds5

About N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide

N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide (PubChem CID 63130322) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
PubChem CID63130322
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
SMILESCCCC1(C(=O)N(C)Cc2ccccn2)CCCNC1
InChIInChI=1S/C16H25N3O/c1-3-8-16(9-6-10-17-13-16)15(20)19(2)12-14-7-4-5-11-18-14/h4-5,7,11,17H,3,6,8-10,12-13H2,1-2H3
InChIKeyNBIMKTVSPCDHOO-UHFFFAOYSA-N
XLogP2.21
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-propyl-N-pyridin-2-ylpiperidine-3-carboxamide
CID 55179341
3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 55176838
N-[(4-bromophenyl)methyl]-N-methyl-3-propylpiperidine-3-carboxamide
CID 63130856
N-(furan-2-ylmethyl)-N-methyl-3-propylpiperidine-3-carboxamide
CID 55165654
N-methyl-N-(pyridin-2-ylmethyl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 63709306
N-methyl-N-[(5-methylfuran-2-yl)methyl]-3-propylpiperidine-3-carboxamide
CID 63130099
N-[(2-hydroxyphenyl)methyl]-N-methyl-3-propylpyrrolidine-3-carboxamide
CID 63143991
3-ethyl-N-methyl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 63130194
1-amino-N-methyl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 65466995
N-methyl-N-propan-2-yl-3-propylpiperidine-3-carboxamide
CID 63132392
N-ethyl-2-propyl-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide
CID 106975512
1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide
CID 61482749

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide (CID 63130322) is N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide is CCCC1(C(=O)N(C)Cc2ccccn2)CCCNC1.
What is the InChIKey of N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide?
The InChIKey is NBIMKTVSPCDHOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-3-8-16(9-6-10-17-13-16)15(20)19(2)12-14-7-4-5-11-18-14/h4-5,7,11,17H,3,6,8-10,12-13H2,1-2H3.
What are the key properties of N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide?
N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 63130322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).