6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one

C14H25NO — CID 106655401

IUPAC6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one
SMILESCCC(CCN)CCC(=O)C1=CCCCC1
InChIInChI=1S/C14H25NO/c1-2-12(10-11-15)8-9-14(16)13-6-4-3-5-7-13/h6,12H,2-5,7-11,15H2,1H3
InChIKeyFCTIODUPDZTVKM-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.21
Rot. Bonds7

About 6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one

6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one (PubChem CID 106655401) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one.

Molecular Properties

Compound Name6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one
PubChem CID106655401
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one
SMILESCCC(CCN)CCC(=O)C1=CCCCC1
InChIInChI=1S/C14H25NO/c1-2-12(10-11-15)8-9-14(16)13-6-4-3-5-7-13/h6,12H,2-5,7-11,15H2,1H3
InChIKeyFCTIODUPDZTVKM-UHFFFAOYSA-N
XLogP3.21
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(aminomethyl)-1-(cyclohexen-1-yl)pentan-1-one
CID 106655578
3-amino-1-(cyclohepten-1-yl)propan-1-one
CID 106655124
5-amino-1-(cycloocten-1-yl)hexan-1-one
CID 106655703
6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide
CID 106175300
6-amino-1-(cyclohexen-1-yl)-2-methylheptan-1-one
CID 106655363
1-(cyclohepten-1-yl)-3-methylhexan-1-one
CID 103450521
1-(cyclohepten-1-yl)-4-ethylsulfonylbutan-1-one
CID 103450590
2-(2-aminoethoxy)-1-(cyclohexen-1-yl)ethanone
CID 106655526
6-amino-4-ethyl-1-(4-propan-2-ylphenyl)hexan-1-one
CID 116578308
2-butan-2-ylsulfanyl-1-(cycloocten-1-yl)ethanone
CID 106651882
1-(cyclopenten-1-yl)tridecan-1-one
CID 103448100
6-amino-4-ethyl-1-thiophen-3-ylhexan-1-one
CID 116578135

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one?
The IUPAC name of 6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one (CID 106655401) is 6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one.
What is the SMILES notation for 6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one?
The canonical SMILES for 6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one is CCC(CCN)CCC(=O)C1=CCCCC1.
What is the InChIKey of 6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one?
The InChIKey is FCTIODUPDZTVKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-2-12(10-11-15)8-9-14(16)13-6-4-3-5-7-13/h6,12H,2-5,7-11,15H2,1H3.
What are the key properties of 6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one?
6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one has a molecular weight of 223.36 g/mol, XLogP of 3.21, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-(cyclohexen-1-yl)-4-ethylhexan-1-one is sourced from PubChem (CID 106655401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).