N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine

C15H22ClNO — CID 62382200

IUPACN-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine
SMILESCC(C)NCC(OC1CCC1)c1ccc(Cl)cc1
InChIInChI=1S/C15H22ClNO/c1-11(2)17-10-15(18-14-4-3-5-14)12-6-8-13(16)9-7-12/h6-9,11,14-15,17H,3-5,10H2,1-2H3
InChIKeyDLNSEWHXLDZHGL-UHFFFAOYSA-N
MW267.80 g/mol
LogP3.95
Rot. Bonds6

About N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine

N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine (PubChem CID 62382200) has the molecular formula C15H22ClNO and a molecular weight of 267.80 g/mol. Its IUPAC name is N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine
PubChem CID62382200
Molecular FormulaC15H22ClNO
Molecular Weight267.80 g/mol
Exact Mass267.14
IUPAC NameN-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine
SMILESCC(C)NCC(OC1CCC1)c1ccc(Cl)cc1
InChIInChI=1S/C15H22ClNO/c1-11(2)17-10-15(18-14-4-3-5-14)12-6-8-13(16)9-7-12/h6-9,11,14-15,17H,3-5,10H2,1-2H3
InChIKeyDLNSEWHXLDZHGL-UHFFFAOYSA-N
XLogP3.95
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.80
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-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 N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine?
The IUPAC name of N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine (CID 62382200) is N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine.
What is the SMILES notation for N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine?
The canonical SMILES for N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine is CC(C)NCC(OC1CCC1)c1ccc(Cl)cc1.
What is the InChIKey of N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine?
The InChIKey is DLNSEWHXLDZHGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO/c1-11(2)17-10-15(18-14-4-3-5-14)12-6-8-13(16)9-7-12/h6-9,11,14-15,17H,3-5,10H2,1-2H3.
What are the key properties of N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine?
N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine has a molecular weight of 267.80 g/mol, XLogP of 3.95, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenyl)-2-cyclobutyloxyethyl]propan-2-amine is sourced from PubChem (CID 62382200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).