3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine

C11H13Cl2NO — CID 66359692

IUPAC3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine
SMILESCNC1CC(Oc2c(Cl)cccc2Cl)C1
InChIInChI=1S/C11H13Cl2NO/c1-14-7-5-8(6-7)15-11-9(12)3-2-4-10(11)13/h2-4,7-8,14H,5-6H2,1H3
InChIKeyMNUMVERFSRTSGB-UHFFFAOYSA-N
MW246.14 g/mol
LogP3.12
Rot. Bonds3

About 3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine

3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine (PubChem CID 66359692) has the molecular formula C11H13Cl2NO and a molecular weight of 246.14 g/mol. Its IUPAC name is 3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine.

Molecular Properties

Compound Name3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine
PubChem CID66359692
Molecular FormulaC11H13Cl2NO
Molecular Weight246.14 g/mol
Exact Mass245.04
IUPAC Name3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine
SMILESCNC1CC(Oc2c(Cl)cccc2Cl)C1
InChIInChI=1S/C11H13Cl2NO/c1-14-7-5-8(6-7)15-11-9(12)3-2-4-10(11)13/h2-4,7-8,14H,5-6H2,1H3
InChIKeyMNUMVERFSRTSGB-UHFFFAOYSA-N
XLogP3.12
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.14
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(2,6-dichlorophenoxy)-N-methylcyclobutan-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

Related Compounds

3-[2,6-di(propan-2-yl)phenoxy]-N-methylcyclobutan-1-amine
CID 66351327
N-[[3-chloro-2-(3,5-dimethylcyclohexyl)oxyphenyl]methyl]cyclopropanamine
CID 115953723
3-(2-chloro-6-nitrophenoxy)-N-propylcyclobutan-1-amine
CID 107719208
3-chloro-N-cyclopentyl-2-methoxyaniline
CID 115884195
3-(2-chlorophenoxy)-N-ethylcyclobutan-1-amine
CID 66357505
4-N-(2-chlorophenyl)-1-N-methylcyclohexane-1,4-diamine
CID 117027455
1-bromo-3-chloro-2-[(1R,3S)-3-methylcyclopentyl]oxybenzene
CID 170070361
3-(2-chloro-4-nitrophenoxy)-N-methylcyclobutan-1-amine
CID 66357280
3-(2,6-dimethylphenoxy)-N-ethylcyclobutan-1-amine
CID 66358499
1-chloro-2-(3-chlorocyclobutyl)oxy-3-nitrobenzene
CID 107719168
3-(2,6-dichlorophenoxy)-N-ethyl-2,2-dimethylcyclobutan-1-amine
CID 66357271
3-chloro-2-(4-methylcyclohexyl)oxyaniline
CID 43187378

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine?
The IUPAC name of 3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine (CID 66359692) is 3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine.
What is the SMILES notation for 3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine?
The canonical SMILES for 3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine is CNC1CC(Oc2c(Cl)cccc2Cl)C1.
What is the InChIKey of 3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine?
The InChIKey is MNUMVERFSRTSGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2NO/c1-14-7-5-8(6-7)15-11-9(12)3-2-4-10(11)13/h2-4,7-8,14H,5-6H2,1H3.
What are the key properties of 3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine?
3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine has a molecular weight of 246.14 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-dichlorophenoxy)-N-methylcyclobutan-1-amine is sourced from PubChem (CID 66359692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).