[4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine

C16H20N2O — CID 82299703

IUPAC[4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine
SMILESNCc1nc(-c2ccc(C3CCCCC3)cc2)co1
InChIInChI=1S/C16H20N2O/c17-10-16-18-15(11-19-16)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,11-12H,1-5,10,17H2
InChIKeyFJTHCUURGZVPLA-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.85
Rot. Bonds3

About [4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine

[4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine (PubChem CID 82299703) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is [4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine.

Molecular Properties

Compound Name[4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine
PubChem CID82299703
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name[4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine
SMILESNCc1nc(-c2ccc(C3CCCCC3)cc2)co1
InChIInChI=1S/C16H20N2O/c17-10-16-18-15(11-19-16)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,11-12H,1-5,10,17H2
InChIKeyFJTHCUURGZVPLA-UHFFFAOYSA-N
XLogP3.85
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine 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-(4-cyclohexylphenyl)-N-methyl-1,3-oxazol-2-amine
CID 116832483
[3-(4-cyclohexylphenyl)-1H-pyrazol-5-yl]methanamine
CID 82482333
(4-cyclohexylphenyl)methanamine
CID 22246867
[4-[4-(trifluoromethoxy)phenyl]-1,3-oxazol-2-yl]methanamine;hydrochloride
CID 157332265
[5-(4-cyclohexylphenyl)-1,3,4-thiadiazol-2-yl]methanamine
CID 82360101
1-cyclohexyl-4-(4-cyclohexylphenyl)benzene;hydrogen peroxide
CID 175051125
[5-(4-cyclohexylphenyl)-2-methyl-1,2,4-triazol-3-yl]methanamine
CID 96667777
[2-(4-cyclohexylphenyl)phenyl]methanamine
CID 63423765
3-(4-cyclohexyl-1,3-oxazol-2-yl)propan-1-amine
CID 115026031
[4-(3-fluorophenyl)-1,3-oxazol-2-yl]methanamine
CID 105445734
4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine
CID 139515276
1-cyclopentyl-4-(4-cyclopentylphenyl)benzene;hydrogen peroxide
CID 175056737

Frequently Asked Questions

What is the IUPAC name of [4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine?
The IUPAC name of [4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine (CID 82299703) is [4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine.
What is the SMILES notation for [4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine?
The canonical SMILES for [4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine is NCc1nc(-c2ccc(C3CCCCC3)cc2)co1.
What is the InChIKey of [4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine?
The InChIKey is FJTHCUURGZVPLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c17-10-16-18-15(11-19-16)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,11-12H,1-5,10,17H2.
What are the key properties of [4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine?
[4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine has a molecular weight of 256.35 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-cyclohexylphenyl)-1,3-oxazol-2-yl]methanamine is sourced from PubChem (CID 82299703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).