N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine

C17H25N — CID 116518650

IUPACN-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine
SMILESCNCC1CCCCC1C1CC1c1ccccc1
InChIInChI=1S/C17H25N/c1-18-12-14-9-5-6-10-15(14)17-11-16(17)13-7-3-2-4-8-13/h2-4,7-8,14-18H,5-6,9-12H2,1H3
InChIKeyAERVPGYLUISKTJ-UHFFFAOYSA-N
MW243.39 g/mol
LogP3.82
Rot. Bonds4

About N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine

N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine (PubChem CID 116518650) has the molecular formula C17H25N and a molecular weight of 243.39 g/mol. Its IUPAC name is N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine
PubChem CID116518650
Molecular FormulaC17H25N
Molecular Weight243.39 g/mol
Exact Mass243.20
IUPAC NameN-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine
SMILESCNCC1CCCCC1C1CC1c1ccccc1
InChIInChI=1S/C17H25N/c1-18-12-14-9-5-6-10-15(14)17-11-16(17)13-7-3-2-4-8-13/h2-4,7-8,14-18H,5-6,9-12H2,1H3
InChIKeyAERVPGYLUISKTJ-UHFFFAOYSA-N
XLogP3.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N-[[2-(2-phenylcyclopropyl)cyclopentyl]methyl]propan-2-amine
CID 116518648
N-[[4-ethyl-2-(2-phenylcyclopropyl)cyclohexyl]methyl]ethanamine
CID 116518670
1-(4,4-dimethyl-2-phenylcyclohexyl)-N-methylmethanamine
CID 81031001
[(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol
CID 11137881
1-[2-(4-tert-butylphenyl)cyclohexyl]-N-methylmethanamine
CID 81027973
1-[2-(4-ethylphenyl)cyclohexyl]-N-methylmethanamine
CID 81028545
1-(2-cyclohexylcycloheptyl)-N-methylmethanamine
CID 81025955
N-methyl-1-[2-(4-propan-2-ylphenyl)cyclohexyl]methanamine
CID 81028814
1-[2-(2-fluorophenyl)cyclohexyl]-N-methylmethanamine
CID 81027217
1-(2-cyclohexylcyclopentyl)-N-methylmethanamine
CID 81033950
1-[2-(3-methoxyphenyl)cycloheptyl]-N-methylmethanamine
CID 81026200
N,N-dimethyl-2-phenylcyclohexan-1-amine
CID 14946175

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine?
The IUPAC name of N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine (CID 116518650) is N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine?
The canonical SMILES for N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine is CNCC1CCCCC1C1CC1c1ccccc1.
What is the InChIKey of N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine?
The InChIKey is AERVPGYLUISKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N/c1-18-12-14-9-5-6-10-15(14)17-11-16(17)13-7-3-2-4-8-13/h2-4,7-8,14-18H,5-6,9-12H2,1H3.
What are the key properties of N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine?
N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine has a molecular weight of 243.39 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine is sourced from PubChem (CID 116518650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).