1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine

C12H16FN — CID 62791210

IUPAC1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
SMILESCNC(c1cc(C)ccc1F)C1CC1
InChIInChI=1S/C12H16FN/c1-8-3-6-11(13)10(7-8)12(14-2)9-4-5-9/h3,6-7,9,12,14H,4-5H2,1-2H3
InChIKeyWPCGPJHABKGDNP-UHFFFAOYSA-N
MW193.26 g/mol
LogP2.80
Rot. Bonds3

About 1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine

1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine (PubChem CID 62791210) has the molecular formula C12H16FN and a molecular weight of 193.26 g/mol. Its IUPAC name is 1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
PubChem CID62791210
Molecular FormulaC12H16FN
Molecular Weight193.26 g/mol
Exact Mass193.13
IUPAC Name1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
SMILESCNC(c1cc(C)ccc1F)C1CC1
InChIInChI=1S/C12H16FN/c1-8-3-6-11(13)10(7-8)12(14-2)9-4-5-9/h3,6-7,9,12,14H,4-5H2,1-2H3
InChIKeyWPCGPJHABKGDNP-UHFFFAOYSA-N
XLogP2.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.26
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-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-(2-fluoro-5-methylphenyl)-N-methyl-1-(4-methylcyclohexyl)methanamine
CID 63415562
1-(4,4-difluorocyclohexyl)-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
CID 105143269
1-(3-ethylcyclopentyl)-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
CID 65409640
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
CID 115852814
1-(2-fluoro-5-methylphenyl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine
CID 115998167
N-[cyclopropyl-(2-fluoro-5-methylphenyl)methyl]ethanamine
CID 62791719
[(2-fluoro-5-methylphenyl)-(4-methylcyclohexyl)methyl]hydrazine
CID 105210507
N-[cyclopropyl-(2-fluoro-5-methylphenyl)methyl]propan-1-amine
CID 62789509
4-[(2,5-difluorophenyl)-(methylamino)methyl]cyclohexan-1-ol
CID 116957012
1-(5-chloro-2-fluorophenyl)-1-cycloheptyl-N-methylmethanamine
CID 114886204
1-(2-chloro-4-fluoro-5-methylphenyl)-1-cyclopropyl-N-methylmethanamine
CID 81045986
1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 65424379

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine?
The IUPAC name of 1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine (CID 62791210) is 1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine is CNC(c1cc(C)ccc1F)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine?
The InChIKey is WPCGPJHABKGDNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN/c1-8-3-6-11(13)10(7-8)12(14-2)9-4-5-9/h3,6-7,9,12,14H,4-5H2,1-2H3.
What are the key properties of 1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine?
1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine has a molecular weight of 193.26 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine is sourced from PubChem (CID 62791210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).