4-[cyclohexyl(ethyl)amino]cyclohexan-1-one

C14H25NO — CID 114761997

IUPAC4-[cyclohexyl(ethyl)amino]cyclohexan-1-one
SMILESCCN(C1CCCCC1)C1CCC(=O)CC1
InChIInChI=1S/C14H25NO/c1-2-15(12-6-4-3-5-7-12)13-8-10-14(16)11-9-13/h12-13H,2-11H2,1H3
InChIKeyLSENRAWYNUAQHV-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.15
Rot. Bonds3

About 4-[cyclohexyl(ethyl)amino]cyclohexan-1-one

4-[cyclohexyl(ethyl)amino]cyclohexan-1-one (PubChem CID 114761997) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 4-[cyclohexyl(ethyl)amino]cyclohexan-1-one.

Molecular Properties

Compound Name4-[cyclohexyl(ethyl)amino]cyclohexan-1-one
PubChem CID114761997
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name4-[cyclohexyl(ethyl)amino]cyclohexan-1-one
SMILESCCN(C1CCCCC1)C1CCC(=O)CC1
InChIInChI=1S/C14H25NO/c1-2-15(12-6-4-3-5-7-12)13-8-10-14(16)11-9-13/h12-13H,2-11H2,1H3
InChIKeyLSENRAWYNUAQHV-UHFFFAOYSA-N
XLogP3.15
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[cyclopropyl(ethyl)amino]cyclopentan-1-one
CID 79642440
4-[cyclohexyl(methyl)amino]cyclohexan-1-one
CID 79119763
4-[di(cyclooctyl)amino]cyclohexan-1-one
CID 138676674
2-[cyclopropyl(ethyl)amino]cycloheptan-1-one
CID 60862924
N-cyclopentyl-N-ethyl-4-methylcyclohexan-1-amine
CID 58662071
N-cyclohexyl-N-ethylazepan-4-amine
CID 63904813
N-cyclohexyl-N-ethyl-5-methylpiperidin-3-amine
CID 115373345
2-[cyclopropyl(ethyl)amino]cyclopentan-1-one
CID 43794934
N-cyclohexyl-N-ethylpyrrolidin-3-amine;hydrochloride
CID 156593457
4-[cyclopropyl(3-methylbutyl)amino]cyclohexan-1-one
CID 114762136
N-cyclohexyl-N-ethylpyrrolidin-3-amine;dihydrochloride
CID 56831616
4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one
CID 117039789

Frequently Asked Questions

What is the IUPAC name of 4-[cyclohexyl(ethyl)amino]cyclohexan-1-one?
The IUPAC name of 4-[cyclohexyl(ethyl)amino]cyclohexan-1-one (CID 114761997) is 4-[cyclohexyl(ethyl)amino]cyclohexan-1-one.
What is the SMILES notation for 4-[cyclohexyl(ethyl)amino]cyclohexan-1-one?
The canonical SMILES for 4-[cyclohexyl(ethyl)amino]cyclohexan-1-one is CCN(C1CCCCC1)C1CCC(=O)CC1.
What is the InChIKey of 4-[cyclohexyl(ethyl)amino]cyclohexan-1-one?
The InChIKey is LSENRAWYNUAQHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-2-15(12-6-4-3-5-7-12)13-8-10-14(16)11-9-13/h12-13H,2-11H2,1H3.
What are the key properties of 4-[cyclohexyl(ethyl)amino]cyclohexan-1-one?
4-[cyclohexyl(ethyl)amino]cyclohexan-1-one has a molecular weight of 223.36 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclohexyl(ethyl)amino]cyclohexan-1-one is sourced from PubChem (CID 114761997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).