N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine

C20H25N — CID 53319785

IUPACN-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine
SMILESCNCC1(c2ccc(-c3ccccc3)cc2)CCCCC1
InChIInChI=1S/C20H25N/c1-21-16-20(14-6-3-7-15-20)19-12-10-18(11-13-19)17-8-4-2-5-9-17/h2,4-5,8-13,21H,3,6-7,14-16H2,1H3
InChIKeyFVJRSFJCTCDWPN-UHFFFAOYSA-N
MW279.43 g/mol
LogP4.77
Rot. Bonds4

About N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine

N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine (PubChem CID 53319785) has the molecular formula C20H25N and a molecular weight of 279.43 g/mol. Its IUPAC name is N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine
PubChem CID53319785
Molecular FormulaC20H25N
Molecular Weight279.43 g/mol
Exact Mass279.20
IUPAC NameN-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine
SMILESCNCC1(c2ccc(-c3ccccc3)cc2)CCCCC1
InChIInChI=1S/C20H25N/c1-21-16-20(14-6-3-7-15-20)19-12-10-18(11-13-19)17-8-4-2-5-9-17/h2,4-5,8-13,21H,3,6-7,14-16H2,1H3
InChIKeyFVJRSFJCTCDWPN-UHFFFAOYSA-N
XLogP4.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine?
The IUPAC name of N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine (CID 53319785) is N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine.
What is the SMILES notation for N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine?
The canonical SMILES for N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine is CNCC1(c2ccc(-c3ccccc3)cc2)CCCCC1.
What is the InChIKey of N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine?
The InChIKey is FVJRSFJCTCDWPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N/c1-21-16-20(14-6-3-7-15-20)19-12-10-18(11-13-19)17-8-4-2-5-9-17/h2,4-5,8-13,21H,3,6-7,14-16H2,1H3.
What are the key properties of N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine?
N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine has a molecular weight of 279.43 g/mol, XLogP of 4.77, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(4-phenylphenyl)cyclohexyl]methanamine is sourced from PubChem (CID 53319785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).