N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine

C14H19Cl2N — CID 62595847

IUPACN-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1(c2c(Cl)cccc2Cl)CC1
InChIInChI=1S/C14H19Cl2N/c1-13(2,3)17-9-14(7-8-14)12-10(15)5-4-6-11(12)16/h4-6,17H,7-9H2,1-3H3
InChIKeyGLEOTUMICCVJSZ-UHFFFAOYSA-N
MW272.22 g/mol
LogP4.41
Rot. Bonds3

About N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine

N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine (PubChem CID 62595847) has the molecular formula C14H19Cl2N and a molecular weight of 272.22 g/mol. Its IUPAC name is N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine
PubChem CID62595847
Molecular FormulaC14H19Cl2N
Molecular Weight272.22 g/mol
Exact Mass271.09
IUPAC NameN-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1(c2c(Cl)cccc2Cl)CC1
InChIInChI=1S/C14H19Cl2N/c1-13(2,3)17-9-14(7-8-14)12-10(15)5-4-6-11(12)16/h4-6,17H,7-9H2,1-3H3
InChIKeyGLEOTUMICCVJSZ-UHFFFAOYSA-N
XLogP4.41
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.22
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-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-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine (CID 62595847) is N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine is CC(C)(C)NCC1(c2c(Cl)cccc2Cl)CC1.
What is the InChIKey of N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine?
The InChIKey is GLEOTUMICCVJSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19Cl2N/c1-13(2,3)17-9-14(7-8-14)12-10(15)5-4-6-11(12)16/h4-6,17H,7-9H2,1-3H3.
What are the key properties of N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine?
N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine has a molecular weight of 272.22 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2,6-dichlorophenyl)cyclopropyl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62595847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).