1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine

C16H29N — CID 104987973

IUPAC1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine
SMILESCNC(C1CCC(C)CC1)C1C2CCCCC21
InChIInChI=1S/C16H29N/c1-11-7-9-12(10-8-11)16(17-2)15-13-5-3-4-6-14(13)15/h11-17H,3-10H2,1-2H3
InChIKeyMEYMPGLFNMVNFF-UHFFFAOYSA-N
MW235.41 g/mol
LogP3.84
Rot. Bonds3

About 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine

1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine (PubChem CID 104987973) has the molecular formula C16H29N and a molecular weight of 235.41 g/mol. Its IUPAC name is 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine.

Molecular Properties

Compound Name1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine
PubChem CID104987973
Molecular FormulaC16H29N
Molecular Weight235.41 g/mol
Exact Mass235.23
IUPAC Name1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine
SMILESCNC(C1CCC(C)CC1)C1C2CCCCC21
InChIInChI=1S/C16H29N/c1-11-7-9-12(10-8-11)16(17-2)15-13-5-3-4-6-14(13)15/h11-17H,3-10H2,1-2H3
InChIKeyMEYMPGLFNMVNFF-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.41
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)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-(6-bicyclo[3.1.0]hexanyl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 104991901
1-(2-adamantyl)-N-methyl-1-(4-methylcyclohexyl)methanamine
CID 104988150
1-cycloheptyl-1-cyclopropyl-N-methylmethanamine
CID 65399883
N-methyl-1-(4-methylcyclohexyl)-1-(4-propylcyclohexyl)methanamine
CID 65423190
(1R)-N-methyl-1-(4-methylcyclohexyl)ethanamine
CID 94033456
1-cycloheptyl-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 65399795
N-[7-bicyclo[4.1.0]heptanyl-(3-methylcyclohexyl)methyl]propan-1-amine
CID 104991950
1-methyl-4-[3-(4-methylcyclohexyl)butan-2-yl]cyclohexane
CID 123821196
1-(3,5-dimethylcyclohexyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 65423221
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-1-cyclopropyl-N-methylmethanamine
CID 104994252
1-(4-ethylcyclohexyl)-N-methyl-1-(3-methylcyclopentyl)methanamine
CID 65413158
N-methyl-1-(4-methylcyclohexyl)-1-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine
CID 79748851

Frequently Asked Questions

What is the IUPAC name of 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine?
The IUPAC name of 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine (CID 104987973) is 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine.
What is the SMILES notation for 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine?
The canonical SMILES for 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine is CNC(C1CCC(C)CC1)C1C2CCCCC21.
What is the InChIKey of 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine?
The InChIKey is MEYMPGLFNMVNFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N/c1-11-7-9-12(10-8-11)16(17-2)15-13-5-3-4-6-14(13)15/h11-17H,3-10H2,1-2H3.
What are the key properties of 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine?
1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine has a molecular weight of 235.41 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-(4-methylcyclohexyl)methanamine is sourced from PubChem (CID 104987973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).