N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide

C16H25N3O — CID 63129561

IUPACN-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NCc2ccc(C)nc2)CCNCC1
InChIInChI=1S/C16H25N3O/c1-3-6-16(7-9-17-10-8-16)15(20)19-12-14-5-4-13(2)18-11-14/h4-5,11,17H,3,6-10,12H2,1-2H3,(H,19,20)
InChIKeyPVCWDVYYCGGGKN-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.18
Rot. Bonds5

About N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide

N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide (PubChem CID 63129561) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide
PubChem CID63129561
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NCc2ccc(C)nc2)CCNCC1
InChIInChI=1S/C16H25N3O/c1-3-6-16(7-9-17-10-8-16)15(20)19-12-14-5-4-13(2)18-11-14/h4-5,11,17H,3,6-10,12H2,1-2H3,(H,19,20)
InChIKeyPVCWDVYYCGGGKN-UHFFFAOYSA-N
XLogP2.18
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-fluorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127194
N-[(3-methylphenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63128555
N-[(3-ethyl-2-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide
CID 82736217
N-[(4-methyl-1,3-thiazol-5-yl)methyl]-4-propylpiperidine-4-carboxamide
CID 63280956
N-[(3-chlorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127551
N-[(3-fluorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127726
4-propyl-N-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxamide
CID 63129181
1-ethyl-3-[(6-methyl-3-pyridinyl)methyl]urea
CID 115583860
N-[(4-propan-2-ylphenyl)methyl]-3-propylpyrrolidine-3-carboxamide
CID 63142507
N-[(4-methylphenyl)methyl]-3-propylpiperidine-3-carboxamide
CID 63132092
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-propylpyrrolidine-3-carboxamide
CID 63141539
N-[(6-methyl-3-pyridinyl)methyl]pyrrolidine-3-carboxamide
CID 63005233

Frequently Asked Questions

What is the IUPAC name of N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide?
The IUPAC name of N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide (CID 63129561) is N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide.
What is the SMILES notation for N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide?
The canonical SMILES for N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide is CCCC1(C(=O)NCc2ccc(C)nc2)CCNCC1.
What is the InChIKey of N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide?
The InChIKey is PVCWDVYYCGGGKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-3-6-16(7-9-17-10-8-16)15(20)19-12-14-5-4-13(2)18-11-14/h4-5,11,17H,3,6-10,12H2,1-2H3,(H,19,20).
What are the key properties of N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide?
N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methyl-3-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide is sourced from PubChem (CID 63129561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).