1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide

C14H26N2O — CID 106826694

IUPAC1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide
SMILESCC1(C(=O)NCC2CCCCN2)CCCCC1
InChIInChI=1S/C14H26N2O/c1-14(8-4-2-5-9-14)13(17)16-11-12-7-3-6-10-15-12/h12,15H,2-11H2,1H3,(H,16,17)
InChIKeyIVSYNGKPNDVSBH-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.22
Rot. Bonds3

About 1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide

1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide (PubChem CID 106826694) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide
PubChem CID106826694
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide
SMILESCC1(C(=O)NCC2CCCCN2)CCCCC1
InChIInChI=1S/C14H26N2O/c1-14(8-4-2-5-9-14)13(17)16-11-12-7-3-6-10-15-12/h12,15H,2-11H2,1H3,(H,16,17)
InChIKeyIVSYNGKPNDVSBH-UHFFFAOYSA-N
XLogP2.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide (CID 106826694) is 1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide is CC1(C(=O)NCC2CCCCN2)CCCCC1.
What is the InChIKey of 1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide?
The InChIKey is IVSYNGKPNDVSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-14(8-4-2-5-9-14)13(17)16-11-12-7-3-6-10-15-12/h12,15H,2-11H2,1H3,(H,16,17).
What are the key properties of 1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide?
1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 2.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 106826694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).