1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine

C15H21Cl2N — CID 107311774

IUPAC1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine
SMILESCCNC(Cc1cccc(Cl)c1Cl)CC1CCC1
InChIInChI=1S/C15H21Cl2N/c1-2-18-13(9-11-5-3-6-11)10-12-7-4-8-14(16)15(12)17/h4,7-8,11,13,18H,2-3,5-6,9-10H2,1H3
InChIKeyCZVBEIDCYFKIEW-UHFFFAOYSA-N
MW286.25 g/mol
LogP4.70
Rot. Bonds6

About 1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine

1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine (PubChem CID 107311774) has the molecular formula C15H21Cl2N and a molecular weight of 286.25 g/mol. Its IUPAC name is 1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine.

Molecular Properties

Compound Name1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine
PubChem CID107311774
Molecular FormulaC15H21Cl2N
Molecular Weight286.25 g/mol
Exact Mass285.11
IUPAC Name1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine
SMILESCCNC(Cc1cccc(Cl)c1Cl)CC1CCC1
InChIInChI=1S/C15H21Cl2N/c1-2-18-13(9-11-5-3-6-11)10-12-7-4-8-14(16)15(12)17/h4,7-8,11,13,18H,2-3,5-6,9-10H2,1H3
InChIKeyCZVBEIDCYFKIEW-UHFFFAOYSA-N
XLogP4.70
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.25
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-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

Related Compounds

1-(2-chlorophenyl)-3-cyclohexyl-N-ethylpropan-2-amine
CID 63415363
2-(2,3-dichlorophenyl)-N-ethyl-1-(3-ethylcyclohexyl)ethanamine
CID 107308723
1-cyclopropyl-3-(2,6-dichlorophenyl)-N-ethylpropan-2-amine
CID 64906804
1-(2-chlorophenyl)-3-cyclobutyl-N-methylpropan-2-amine
CID 65459954
2-(2,3-dichlorophenyl)-N-ethyl-1-(oxan-4-yl)ethanamine
CID 107308697
1-(2,3-dichlorophenyl)-N-ethyl-3-methylsulfanylpropan-2-amine
CID 107308560
1-(2,3-dichlorophenyl)-3-(oxolan-3-yl)-N-propylpropan-2-amine
CID 107309012
1-(2-bromo-3-fluorophenyl)-3-cyclopentyl-N-ethylpropan-2-amine
CID 105020430
4-cyclopentyl-1-(2,3-dichlorophenyl)-N-methylbutan-2-amine
CID 107312312
1-(2-chloro-4-fluorophenyl)-3-cyclohexyl-N-ethylpropan-2-amine
CID 63420165
1-(2-bromo-3-fluorophenyl)-3-cyclohexyl-N-ethylpropan-2-amine
CID 105020439
N-[cyclobutyl-(2,3-dichlorophenyl)methyl]ethanamine
CID 64986692

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine?
The IUPAC name of 1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine (CID 107311774) is 1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine.
What is the SMILES notation for 1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine?
The canonical SMILES for 1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine is CCNC(Cc1cccc(Cl)c1Cl)CC1CCC1.
What is the InChIKey of 1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine?
The InChIKey is CZVBEIDCYFKIEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21Cl2N/c1-2-18-13(9-11-5-3-6-11)10-12-7-4-8-14(16)15(12)17/h4,7-8,11,13,18H,2-3,5-6,9-10H2,1H3.
What are the key properties of 1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine?
1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine has a molecular weight of 286.25 g/mol, XLogP of 4.70, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-3-(2,3-dichlorophenyl)-N-ethylpropan-2-amine is sourced from PubChem (CID 107311774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).