N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine

C18H23N — CID 105094431

IUPACN-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine
SMILESCNC(CCc1ccc(C)cc1)c1ccccc1C
InChIInChI=1S/C18H23N/c1-14-8-10-16(11-9-14)12-13-18(19-3)17-7-5-4-6-15(17)2/h4-11,18-19H,12-13H2,1-3H3
InChIKeyXZRAZJFICASMKE-UHFFFAOYSA-N
MW253.39 g/mol
LogP4.20
Rot. Bonds5

About N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine

N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine (PubChem CID 105094431) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine.

Molecular Properties

Compound NameN-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine
PubChem CID105094431
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC NameN-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine
SMILESCNC(CCc1ccc(C)cc1)c1ccccc1C
InChIInChI=1S/C18H23N/c1-14-8-10-16(11-9-14)12-13-18(19-3)17-7-5-4-6-15(17)2/h4-11,18-19H,12-13H2,1-3H3
InChIKeyXZRAZJFICASMKE-UHFFFAOYSA-N
XLogP4.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,5-dimethylphenyl)-N-methyl-3-(4-methylphenyl)propan-1-amine
CID 105120019
N-methyl-1-(2-methylphenyl)-3-pyridin-2-ylpropan-1-amine
CID 105094755
1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 43482663
N-methyl-1-(2-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103009289
N-methyl-1-(2-methylphenyl)pent-4-yn-1-amine
CID 63657700
1-(2,4-difluorophenyl)-N-methyl-3-(4-methylphenyl)propan-1-amine
CID 105143608
1-(2,5-dimethylphenyl)-N-methyl-4-phenylbutan-1-amine
CID 115849503
N-methyl-1-(2-methylphenyl)-2-phenylethanamine
CID 60819180
N-ethyl-3-(4-methoxyphenyl)-1-(2-methylphenyl)propan-1-amine
CID 65444570
N-methyl-3-(4-methylphenyl)-1-(5-methylthiophen-2-yl)propan-1-amine
CID 105161960
N-methyl-1-(4-methyl-3-pyridinyl)-3-pyridin-4-ylpropan-1-amine
CID 105164185
N-methyl-1-(2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanamine
CID 63413775

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine?
The IUPAC name of N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine (CID 105094431) is N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine.
What is the SMILES notation for N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine?
The canonical SMILES for N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine is CNC(CCc1ccc(C)cc1)c1ccccc1C.
What is the InChIKey of N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine?
The InChIKey is XZRAZJFICASMKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-14-8-10-16(11-9-14)12-13-18(19-3)17-7-5-4-6-15(17)2/h4-11,18-19H,12-13H2,1-3H3.
What are the key properties of N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine?
N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine has a molecular weight of 253.39 g/mol, XLogP of 4.20, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine is sourced from PubChem (CID 105094431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).