N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide

C16H31N3O — CID 103912850

IUPACN,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(NCC2(C)CCCCC2)CC1
InChIInChI=1S/C16H31N3O/c1-16(9-5-4-6-10-16)13-17-14-7-11-19(12-8-14)15(20)18(2)3/h14,17H,4-13H2,1-3H3
InChIKeyDQTVJTUZCCZTKK-UHFFFAOYSA-N
MW281.44 g/mol
LogP2.69
Rot. Bonds3

About N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide

N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide (PubChem CID 103912850) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide
PubChem CID103912850
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(NCC2(C)CCCCC2)CC1
InChIInChI=1S/C16H31N3O/c1-16(9-5-4-6-10-16)13-17-14-7-11-19(12-8-14)15(20)18(2)3/h14,17H,4-13H2,1-3H3
InChIKeyDQTVJTUZCCZTKK-UHFFFAOYSA-N
XLogP2.69
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-Acetylpiperidin-4-yl)-3-(4,4-dimethylcyclohexyl)urea
CID 53317890
1-(1-Acetylpiperidin-4-yl)-3-(4-tert-butylcyclohexyl)urea
CID 53320344
N-Isopropyl-3,9-diazaspiro[5.5]undecane-3-carboxamide
CID 3234223
1-Cyclohexyl-3-(2,2,6,6-tetramethylpiperidin-4-yl)urea
CID 707316
N-propyl-N'-(2,2,6,6-tetramethyl-4-piperidinyl)urea
CID 2277117
N-cyclohexyl-4-methylpiperidine-1-carboxamide
CID 4207227
(5R)-N-propan-2-yl-2,9-diazaspiro[4.5]decane-2-carboxamide
CID 3234965
1-Methyl-3-(4-methylcyclohexyl)-1-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]urea
CID 56827100
N-(1-cyclopropylpiperidin-4-yl)-2-azaspiro[4.5]decane-2-carboxamide
CID 71926055
1-(Cyclooctylmethyl)-3-(1-propan-2-ylpiperidin-4-yl)urea
CID 99812812
3-[3-[[[(Diisopropylamino)carbonyl]amino]methyl]-3,5,5-trimethylcyclohexyl]-1,1-diisopropylurea
CID 3020089
2-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]piperidine-1-carboxamide
CID 69466705

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide?
The IUPAC name of N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide (CID 103912850) is N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide?
The canonical SMILES for N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide is CN(C)C(=O)N1CCC(NCC2(C)CCCCC2)CC1.
What is the InChIKey of N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide?
The InChIKey is DQTVJTUZCCZTKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-16(9-5-4-6-10-16)13-17-14-7-11-19(12-8-14)15(20)18(2)3/h14,17H,4-13H2,1-3H3.
What are the key properties of N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide?
N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide has a molecular weight of 281.44 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(1-methylcyclohexyl)methylamino]piperidine-1-carboxamide is sourced from PubChem (CID 103912850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).