3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine

C16H20N2O3 — CID 67811905

IUPAC3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine
SMILESCOc1ccc(Cc2cc(N)on2)cc1OC1CCCC1
InChIInChI=1S/C16H20N2O3/c1-19-14-7-6-11(8-12-10-16(17)21-18-12)9-15(14)20-13-4-2-3-5-13/h6-7,9-10,13H,2-5,8,17H2,1H3
InChIKeyUCGCKCRFFGRTFG-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.18
Rot. Bonds5

About 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine

3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine (PubChem CID 67811905) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine
PubChem CID67811905
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine
SMILESCOc1ccc(Cc2cc(N)on2)cc1OC1CCCC1
InChIInChI=1S/C16H20N2O3/c1-19-14-7-6-11(8-12-10-16(17)21-18-12)9-15(14)20-13-4-2-3-5-13/h6-7,9-10,13H,2-5,8,17H2,1H3
InChIKeyUCGCKCRFFGRTFG-UHFFFAOYSA-N
XLogP3.18
TPSA70.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine 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-cyclopentyloxy-4-methoxyphenyl)methylhydrazine
CID 143235659
1,3-dichloro-2-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]benzene
CID 21221257
(3-cyclopentyloxy-4-methoxyphenyl)methyl cyclohexanecarboxylate
CID 174456641
2-(3-cyclobutyloxy-4-methoxyphenyl)ethanol
CID 117318425
2-(3-cyclopentyloxy-4-methoxyphenyl)acetonitrile;hydrochloride
CID 172691211
3-(3-cyclopentyloxy-4-methoxyphenyl)-2-methylpropanenitrile
CID 70064225
1-(3-cyclobutyloxy-4-methoxyphenyl)-N-methoxymethanamine
CID 117346957
2-cyclopentyloxy-4-iodo-1-methoxybenzene
CID 11197924
3-(3-cyclopentyloxy-4-methoxyphenyl)-N,N-dimethylpropan-1-amine
CID 170865862
3-[4-methoxy-3-(oxan-3-yloxy)phenyl]-1,2-oxazol-5-amine
CID 117469039
[4-methoxy-3-(thian-4-yloxy)phenyl]methanamine
CID 115005336
3-[(2-methoxy-5-propan-2-ylphenyl)methyl]-1,2-oxazol-5-amine
CID 82086137

Frequently Asked Questions

What is the IUPAC name of 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine?
The IUPAC name of 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine (CID 67811905) is 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine.
What is the SMILES notation for 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine?
The canonical SMILES for 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine is COc1ccc(Cc2cc(N)on2)cc1OC1CCCC1.
What is the InChIKey of 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine?
The InChIKey is UCGCKCRFFGRTFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-19-14-7-6-11(8-12-10-16(17)21-18-12)9-15(14)20-13-4-2-3-5-13/h6-7,9-10,13H,2-5,8,17H2,1H3.
What are the key properties of 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine?
3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine has a molecular weight of 288.35 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,2-oxazol-5-amine is sourced from PubChem (CID 67811905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).