1-(cyclohexylmethyl)cyclohexane-1-carboxamide

C14H25NO — CID 135031421

IUPAC1-(cyclohexylmethyl)cyclohexane-1-carboxamide
SMILESNC(=O)C1(CC2CCCCC2)CCCCC1
InChIInChI=1S/C14H25NO/c15-13(16)14(9-5-2-6-10-14)11-12-7-3-1-4-8-12/h12H,1-11H2,(H2,15,16)
InChIKeyWSINKNZJVSOJGW-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.39
Rot. Bonds3

About 1-(cyclohexylmethyl)cyclohexane-1-carboxamide

1-(cyclohexylmethyl)cyclohexane-1-carboxamide (PubChem CID 135031421) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclohexylmethyl)cyclohexane-1-carboxamide
PubChem CID135031421
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name1-(cyclohexylmethyl)cyclohexane-1-carboxamide
SMILESNC(=O)C1(CC2CCCCC2)CCCCC1
InChIInChI=1S/C14H25NO/c15-13(16)14(9-5-2-6-10-14)11-12-7-3-1-4-8-12/h12H,1-11H2,(H2,15,16)
InChIKeyWSINKNZJVSOJGW-UHFFFAOYSA-N
XLogP3.39
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-(cyclohexylmethyl)cyclohexane-1-carboxamide (CID 135031421) is 1-(cyclohexylmethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-(cyclohexylmethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-(cyclohexylmethyl)cyclohexane-1-carboxamide is NC(=O)C1(CC2CCCCC2)CCCCC1.
What is the InChIKey of 1-(cyclohexylmethyl)cyclohexane-1-carboxamide?
The InChIKey is WSINKNZJVSOJGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c15-13(16)14(9-5-2-6-10-14)11-12-7-3-1-4-8-12/h12H,1-11H2,(H2,15,16).
What are the key properties of 1-(cyclohexylmethyl)cyclohexane-1-carboxamide?
1-(cyclohexylmethyl)cyclohexane-1-carboxamide has a molecular weight of 223.36 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 135031421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).