1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide

C15H27N3O2 — CID 62783233

IUPAC1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCCC(C(=O)N2CC(C(N)=O)CCC2C)C1N
InChIInChI=1S/C15H27N3O2/c1-9-4-3-5-12(13(9)16)15(20)18-8-11(14(17)19)7-6-10(18)2/h9-13H,3-8,16H2,1-2H3,(H2,17,19)
InChIKeyIZVDTHISAKHYQF-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.86
Rot. Bonds2

About 1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide

1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide (PubChem CID 62783233) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide
PubChem CID62783233
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCCC(C(=O)N2CC(C(N)=O)CCC2C)C1N
InChIInChI=1S/C15H27N3O2/c1-9-4-3-5-12(13(9)16)15(20)18-8-11(14(17)19)7-6-10(18)2/h9-13H,3-8,16H2,1-2H3,(H2,17,19)
InChIKeyIZVDTHISAKHYQF-UHFFFAOYSA-N
XLogP0.86
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide?
The IUPAC name of 1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide (CID 62783233) is 1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide is CC1CCCC(C(=O)N2CC(C(N)=O)CCC2C)C1N.
What is the InChIKey of 1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide?
The InChIKey is IZVDTHISAKHYQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-9-4-3-5-12(13(9)16)15(20)18-8-11(14(17)19)7-6-10(18)2/h9-13H,3-8,16H2,1-2H3,(H2,17,19).
What are the key properties of 1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide?
1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide has a molecular weight of 281.40 g/mol, XLogP of 0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-3-methylcyclohexanecarbonyl)-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 62783233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).