1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine

C14H15ClN2O — CID 84599080

IUPAC1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine
SMILESCc1cc(CNC2(c3ccc(Cl)cc3)CC2)no1
InChIInChI=1S/C14H15ClN2O/c1-10-8-13(17-18-10)9-16-14(6-7-14)11-2-4-12(15)5-3-11/h2-5,8,16H,6-7,9H2,1H3
InChIKeyGPWOHAPPURYCGC-UHFFFAOYSA-N
MW262.74 g/mol
LogP3.42
Rot. Bonds4

About 1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine

1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine (PubChem CID 84599080) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine
PubChem CID84599080
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC Name1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine
SMILESCc1cc(CNC2(c3ccc(Cl)cc3)CC2)no1
InChIInChI=1S/C14H15ClN2O/c1-10-8-13(17-18-10)9-16-14(6-7-14)11-2-4-12(15)5-3-11/h2-5,8,16H,6-7,9H2,1H3
InChIKeyGPWOHAPPURYCGC-UHFFFAOYSA-N
XLogP3.42
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine?
The IUPAC name of 1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine (CID 84599080) is 1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine.
What is the SMILES notation for 1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine?
The canonical SMILES for 1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine is Cc1cc(CNC2(c3ccc(Cl)cc3)CC2)no1.
What is the InChIKey of 1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine?
The InChIKey is GPWOHAPPURYCGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c1-10-8-13(17-18-10)9-16-14(6-7-14)11-2-4-12(15)5-3-11/h2-5,8,16H,6-7,9H2,1H3.
What are the key properties of 1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine?
1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine has a molecular weight of 262.74 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopropan-1-amine is sourced from PubChem (CID 84599080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).