1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine

C16H25N — CID 65399402

IUPAC1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine
SMILESCNC(c1cccc(C)c1)C1CCCCCC1
InChIInChI=1S/C16H25N/c1-13-8-7-11-15(12-13)16(17-2)14-9-5-3-4-6-10-14/h7-8,11-12,14,16-17H,3-6,9-10H2,1-2H3
InChIKeyWNJZXDZSRQSPDK-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.23
Rot. Bonds3

About 1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine

1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine (PubChem CID 65399402) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine.

Molecular Properties

Compound Name1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine
PubChem CID65399402
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine
SMILESCNC(c1cccc(C)c1)C1CCCCCC1
InChIInChI=1S/C16H25N/c1-13-8-7-11-15(12-13)16(17-2)14-9-5-3-4-6-10-14/h7-8,11-12,14,16-17H,3-6,9-10H2,1-2H3
InChIKeyWNJZXDZSRQSPDK-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine 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-N-methyl-1-(3-methylphenyl)methanamine
CID 60818000
N-methyl-4-[methylamino-(3-methylphenyl)methyl]cyclohexan-1-amine
CID 116952360
N-[cycloheptyl-(3-methylphenyl)methyl]ethanamine
CID 65399254
1-(3-chlorophenyl)-1-cycloheptyl-N-methylmethanamine
CID 65400043
1-(4-ethylcyclohexyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 64774200
N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine
CID 60818890
1-(3-bicyclo[3.1.0]hexanyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 115789805
1-cycloheptyl-N-methyl-1-[3-(trifluoromethyl)phenyl]methanamine
CID 65399168
1-(3-cyclobutylphenyl)-1-cyclopentyl-N-methylmethanamine
CID 114602754
N-methyl-1-(3-methylphenyl)-1-[2-(trifluoromethyl)cyclohexyl]methanamine
CID 105090899
2-cycloheptyl-N-methyl-1-(3-methylphenyl)ethanamine
CID 115789919
N-methyl-1-(3-methylphenyl)-1-pyrrolidin-2-ylmethanamine
CID 116950968

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine?
The IUPAC name of 1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine (CID 65399402) is 1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine.
What is the SMILES notation for 1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine?
The canonical SMILES for 1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine is CNC(c1cccc(C)c1)C1CCCCCC1.
What is the InChIKey of 1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine?
The InChIKey is WNJZXDZSRQSPDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-13-8-7-11-15(12-13)16(17-2)14-9-5-3-4-6-10-14/h7-8,11-12,14,16-17H,3-6,9-10H2,1-2H3.
What are the key properties of 1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine?
1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine has a molecular weight of 231.38 g/mol, XLogP of 4.23, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine is sourced from PubChem (CID 65399402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).