1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide

C14H27N3O — CID 115277550

IUPAC1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide
SMILESCNC1CCC(NC(=O)C2CCN(C)CC2)CC1
InChIInChI=1S/C14H27N3O/c1-15-12-3-5-13(6-4-12)16-14(18)11-7-9-17(2)10-8-11/h11-13,15H,3-10H2,1-2H3,(H,16,18)
InChIKeyKHKHYIFYOJQNLR-UHFFFAOYSA-N
MW253.39 g/mol
LogP0.98
Rot. Bonds3

About 1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide

1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide (PubChem CID 115277550) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide
PubChem CID115277550
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide
SMILESCNC1CCC(NC(=O)C2CCN(C)CC2)CC1
InChIInChI=1S/C14H27N3O/c1-15-12-3-5-13(6-4-12)16-14(18)11-7-9-17(2)10-8-11/h11-13,15H,3-10H2,1-2H3,(H,16,18)
InChIKeyKHKHYIFYOJQNLR-UHFFFAOYSA-N
XLogP0.98
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide
CID 153459282
4-(methylamino)-N-(1-methylpyrrolidin-3-yl)cyclohexane-1-carboxamide
CID 115150628
N,1-dimethylpiperidine-4-carboxamide;ethane
CID 156719814
4-(hydroxymethyl)-N-(1-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 115151158
3-amino-N-(1-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 62775601
4-[(1-acetylpiperidine-4-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 60807892
N-(1-methylpyrrolidin-3-yl)piperidine-4-carboxamide
CID 61465348
ethane;N-methyl-1-(1-methylpiperidin-4-yl)piperidine-4-carboxamide
CID 166167704
N-cyclopropylcycloheptanecarboxamide
CID 62778853
N-cyclopropylcyclohexanecarboxamide
CID 3412875
1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride
CID 120576315
N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]cyclopentanecarboxamide
CID 45181380

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide?
The IUPAC name of 1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide (CID 115277550) is 1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide?
The canonical SMILES for 1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide is CNC1CCC(NC(=O)C2CCN(C)CC2)CC1.
What is the InChIKey of 1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide?
The InChIKey is KHKHYIFYOJQNLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-15-12-3-5-13(6-4-12)16-14(18)11-7-9-17(2)10-8-11/h11-13,15H,3-10H2,1-2H3,(H,16,18).
What are the key properties of 1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide?
1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 0.98, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide is sourced from PubChem (CID 115277550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).