1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine

C11H13F2N — CID 43484588

IUPAC1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine
SMILESCNC(c1ccc(F)c(F)c1)C1CC1
InChIInChI=1S/C11H13F2N/c1-14-11(7-2-3-7)8-4-5-9(12)10(13)6-8/h4-7,11,14H,2-3H2,1H3
InChIKeyCACNRSOTMSLBJO-UHFFFAOYSA-N
MW197.23 g/mol
LogP2.64
Rot. Bonds3

About 1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine

1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine (PubChem CID 43484588) has the molecular formula C11H13F2N and a molecular weight of 197.23 g/mol. Its IUPAC name is 1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine
PubChem CID43484588
Molecular FormulaC11H13F2N
Molecular Weight197.23 g/mol
Exact Mass197.10
IUPAC Name1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine
SMILESCNC(c1ccc(F)c(F)c1)C1CC1
InChIInChI=1S/C11H13F2N/c1-14-11(7-2-3-7)8-4-5-9(12)10(13)6-8/h4-7,11,14H,2-3H2,1H3
InChIKeyCACNRSOTMSLBJO-UHFFFAOYSA-N
XLogP2.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine 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-cyclohexyl-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
CID 54919033
1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-(4-methylcyclohexyl)methanamine
CID 104988080
[(4-tert-butylcyclohexyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105232707
1-(3,4-difluorophenyl)-N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)methanamine
CID 79914897
1-cycloheptyl-1-(3-fluoro-4-methoxyphenyl)-N-methylmethanamine
CID 62587575
1-(4,4-difluorocyclohexyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
CID 107130403
1-(3,4-difluorophenyl)-1-(2,2-dimethylcyclohexyl)-N-methylmethanamine
CID 107177248
1-(4-chlorophenyl)-N-methyl-1-(4-methylcyclohexyl)methanamine
CID 55185676
1-[4-fluoro-3-(trifluoromethyl)phenyl]-N-methyl-1-(oxan-4-yl)methanamine
CID 115855875
1-(3-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 65424185
N-[cyclopropyl(phenyl)methyl]-1-(3,4-difluorophenyl)ethanamine
CID 43724263
1-(4-chlorophenyl)-1-cyclopentyl-N-methylmethanamine
CID 43481459

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine?
The IUPAC name of 1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine (CID 43484588) is 1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine?
The canonical SMILES for 1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine is CNC(c1ccc(F)c(F)c1)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine?
The InChIKey is CACNRSOTMSLBJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F2N/c1-14-11(7-2-3-7)8-4-5-9(12)10(13)6-8/h4-7,11,14H,2-3H2,1H3.
What are the key properties of 1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine?
1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine has a molecular weight of 197.23 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(3,4-difluorophenyl)-N-methylmethanamine is sourced from PubChem (CID 43484588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).