(4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one

C15H18O2 — CID 163035712

IUPAC(4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one
SMILESCOc1ccc(CC[C@H]2C=CC(=O)CC2)cc1
InChIInChI=1S/C15H18O2/c1-17-15-10-6-13(7-11-15)3-2-12-4-8-14(16)9-5-12/h4,6-8,10-12H,2-3,5,9H2,1H3/t12-/m0/s1
InChIKeyKYIZWSVXYSIPKA-LBPRGKRZSA-N
MW230.31 g/mol
LogP3.16
Rot. Bonds4

About (4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one

(4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one (PubChem CID 163035712) has the molecular formula C15H18O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is (4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one.

Molecular Properties

Compound Name(4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one
PubChem CID163035712
Molecular FormulaC15H18O2
Molecular Weight230.31 g/mol
Exact Mass230.13
IUPAC Name(4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one
SMILESCOc1ccc(CC[C@H]2C=CC(=O)CC2)cc1
InChIInChI=1S/C15H18O2/c1-17-15-10-6-13(7-11-15)3-2-12-4-8-14(16)9-5-12/h4,6-8,10-12H,2-3,5,9H2,1H3/t12-/m0/s1
InChIKeyKYIZWSVXYSIPKA-LBPRGKRZSA-N
XLogP3.16
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-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

[2-[2-(4-methoxyphenyl)ethyl]cycloheptyl]methanamine
CID 81010620
(4S)-4-[2-(4-methoxyphenyl)ethyl]-1,3-oxazolidin-2-one
CID 10933011
(3S)-3-[2-(4-methoxyphenyl)ethyl]-1-methylpyrrolidine
CID 150264737
4-ethyl-2-[2-(4-methoxyphenyl)ethyl]cyclohexan-1-ol
CID 79422404
[2-[2-(4-methoxyphenyl)ethyl]-4-methylcyclohexyl]methanamine
CID 81011075
6-[2-(4-methoxyphenyl)ethyl]-1,3-dimethyl-1,3-diazinane-2,4-dione
CID 135069719
(2S,6R)-2-(4-methoxyphenyl)-6-[2-(4-methoxyphenyl)ethyl]oxane
CID 162820309
N-[[2-[2-(4-methoxyphenyl)ethyl]cyclohexyl]methyl]propan-2-amine
CID 81027041
5-[2-(4-methoxyphenyl)ethyl]-2-methylpiperidine
CID 106779333
3-[2-(4-methoxyphenyl)ethyl]cycloheptan-1-amine
CID 65443041
2-[2-(4-methoxyphenyl)ethyl]adamantane
CID 158701742
5-[5-(4-methoxyphenyl)pentyl]-2,2-dimethyl-1,3-dioxane-4,6-dione
CID 132539772

Frequently Asked Questions

What is the IUPAC name of (4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one?
The IUPAC name of (4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one (CID 163035712) is (4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one.
What is the SMILES notation for (4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one?
The canonical SMILES for (4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one is COc1ccc(CC[C@H]2C=CC(=O)CC2)cc1.
What is the InChIKey of (4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one?
The InChIKey is KYIZWSVXYSIPKA-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H18O2/c1-17-15-10-6-13(7-11-15)3-2-12-4-8-14(16)9-5-12/h4,6-8,10-12H,2-3,5,9H2,1H3/t12-/m0/s1.
What are the key properties of (4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one?
(4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one has a molecular weight of 230.31 g/mol, XLogP of 3.16, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-[2-(4-methoxyphenyl)ethyl]cyclohex-2-en-1-one is sourced from PubChem (CID 163035712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).