N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide

C17H32N2O — CID 63128373

IUPACN-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)N(C)CC2CCCCC2)CCNCC1
InChIInChI=1S/C17H32N2O/c1-3-9-17(10-12-18-13-11-17)16(20)19(2)14-15-7-5-4-6-8-15/h15,18H,3-14H2,1-2H3
InChIKeyDEQRQZUHZMCPPF-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.19
Rot. Bonds5

About N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide

N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide (PubChem CID 63128373) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide
PubChem CID63128373
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC NameN-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)N(C)CC2CCCCC2)CCNCC1
InChIInChI=1S/C17H32N2O/c1-3-9-17(10-12-18-13-11-17)16(20)19(2)14-15-7-5-4-6-8-15/h15,18H,3-14H2,1-2H3
InChIKeyDEQRQZUHZMCPPF-UHFFFAOYSA-N
XLogP3.19
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(oxan-2-ylmethyl)-4-propylpiperidine-4-carboxamide
CID 63129141
N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide
CID 63142224
N-methyl-N-(oxan-4-ylmethyl)-3-propylpyrrolidine-3-carboxamide
CID 55226836
N-ethyl-N-methyl-4-propylpiperidine-4-carboxamide
CID 63127606
N-(cyclohexylmethyl)-4-methoxy-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119704445
N-(cyclopentylmethyl)-4-methoxy-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119759240
N-(cyclopentylmethyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 63657339
N-(cyclobutylmethyl)-4-methoxy-N-methylpiperidine-4-carboxamide
CID 119770688
cyclopentyl-(4-propylpiperidin-4-yl)methanone
CID 116569037
1-(aminomethyl)-N-(cyclopentylmethyl)-N-methylcyclopropane-1-carboxamide
CID 80598771
N-(2-amino-2-oxoethyl)-N-cyclopentyl-4-propylpiperidine-4-carboxamide
CID 63128358
N-(cyclohexylmethyl)-N-methyl-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 63709696

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide?
The IUPAC name of N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide (CID 63128373) is N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide.
What is the SMILES notation for N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide?
The canonical SMILES for N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide is CCCC1(C(=O)N(C)CC2CCCCC2)CCNCC1.
What is the InChIKey of N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide?
The InChIKey is DEQRQZUHZMCPPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-3-9-17(10-12-18-13-11-17)16(20)19(2)14-15-7-5-4-6-8-15/h15,18H,3-14H2,1-2H3.
What are the key properties of N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide?
N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide has a molecular weight of 280.46 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide is sourced from PubChem (CID 63128373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).