1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide

C14H26N2O — CID 54894103

IUPAC1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide
SMILESCC1CCCCC1(NC1CCCCC1)C(N)=O
InChIInChI=1S/C14H26N2O/c1-11-7-5-6-10-14(11,13(15)17)16-12-8-3-2-4-9-12/h11-12,16H,2-10H2,1H3,(H2,15,17)
InChIKeyCDEBYQLQZCLGQR-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.34
Rot. Bonds3

About 1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide

1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide (PubChem CID 54894103) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide
PubChem CID54894103
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide
SMILESCC1CCCCC1(NC1CCCCC1)C(N)=O
InChIInChI=1S/C14H26N2O/c1-11-7-5-6-10-14(11,13(15)17)16-12-8-3-2-4-9-12/h11-12,16H,2-10H2,1H3,(H2,15,17)
InChIKeyCDEBYQLQZCLGQR-UHFFFAOYSA-N
XLogP2.34
TPSA55.12 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 ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide?
The IUPAC name of 1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide (CID 54894103) is 1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide?
The canonical SMILES for 1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide is CC1CCCCC1(NC1CCCCC1)C(N)=O.
What is the InChIKey of 1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide?
The InChIKey is CDEBYQLQZCLGQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-11-7-5-6-10-14(11,13(15)17)16-12-8-3-2-4-9-12/h11-12,16H,2-10H2,1H3,(H2,15,17).
What are the key properties of 1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide?
1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 2.34, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylamino)-2-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 54894103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).