(1S)-5-amino-3-phenylcyclohex-2-en-1-ol

C12H15NO — CID 174581206

IUPAC(1S)-5-amino-3-phenylcyclohex-2-en-1-ol
SMILESNC1CC(c2ccccc2)=C[C@@H](O)C1
InChIInChI=1S/C12H15NO/c13-11-6-10(7-12(14)8-11)9-4-2-1-3-5-9/h1-5,7,11-12,14H,6,8,13H2/t11?,12-/m1/s1
InChIKeyFYSOOPAIZCBPFO-PIJUOVFKSA-N
MW189.26 g/mol
LogP1.55
Rot. Bonds1

About (1S)-5-amino-3-phenylcyclohex-2-en-1-ol

(1S)-5-amino-3-phenylcyclohex-2-en-1-ol (PubChem CID 174581206) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is (1S)-5-amino-3-phenylcyclohex-2-en-1-ol.

Molecular Properties

Compound Name(1S)-5-amino-3-phenylcyclohex-2-en-1-ol
PubChem CID174581206
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name(1S)-5-amino-3-phenylcyclohex-2-en-1-ol
SMILESNC1CC(c2ccccc2)=C[C@@H](O)C1
InChIInChI=1S/C12H15NO/c13-11-6-10(7-12(14)8-11)9-4-2-1-3-5-9/h1-5,7,11-12,14H,6,8,13H2/t11?,12-/m1/s1
InChIKeyFYSOOPAIZCBPFO-PIJUOVFKSA-N
XLogP1.55
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1S)-5-amino-3-phenylcyclohex-2-en-1-ol 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

4-phenylcyclopent-3-ene-1,2-diol
CID 85106712
(1S,5S)-3,7-diphenylbicyclo[3.3.1]nona-2,6-diene
CID 10923696
(1R)-3-phenylcyclohex-3-en-1-amine
CID 175905363
3-phenylcyclohept-2-en-1-ol
CID 15145996
(1S)-3-phenylcyclohept-2-en-1-ol
CID 154717661
(1R)-3-phenylcyclohept-2-en-1-ol
CID 154716148
5-[(4-methoxyphenyl)methyl]-3-phenylcyclohex-3-en-1-amine
CID 175741728
3-phenylbicyclo[3.1.0]hex-2-ene
CID 13395700
(1R,4S)-3,4-diphenylcyclopent-2-en-1-ol
CID 92533373
(1R)-4-phenylcyclohex-3-en-1-amine
CID 86306547
CID 136763086
CID 136763086
(1R,8S)-10-phenyltricyclo[6.3.1.02,7]dodeca-2(7),9-diene
CID 102028127

Frequently Asked Questions

What is the IUPAC name of (1S)-5-amino-3-phenylcyclohex-2-en-1-ol?
The IUPAC name of (1S)-5-amino-3-phenylcyclohex-2-en-1-ol (CID 174581206) is (1S)-5-amino-3-phenylcyclohex-2-en-1-ol.
What is the SMILES notation for (1S)-5-amino-3-phenylcyclohex-2-en-1-ol?
The canonical SMILES for (1S)-5-amino-3-phenylcyclohex-2-en-1-ol is NC1CC(c2ccccc2)=C[C@@H](O)C1.
What is the InChIKey of (1S)-5-amino-3-phenylcyclohex-2-en-1-ol?
The InChIKey is FYSOOPAIZCBPFO-PIJUOVFKSA-N. The full InChI is InChI=1S/C12H15NO/c13-11-6-10(7-12(14)8-11)9-4-2-1-3-5-9/h1-5,7,11-12,14H,6,8,13H2/t11?,12-/m1/s1.
What are the key properties of (1S)-5-amino-3-phenylcyclohex-2-en-1-ol?
(1S)-5-amino-3-phenylcyclohex-2-en-1-ol has a molecular weight of 189.26 g/mol, XLogP of 1.55, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-5-amino-3-phenylcyclohex-2-en-1-ol is sourced from PubChem (CID 174581206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).