N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine

C19H25N — CID 64984941

IUPACN-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine
SMILESCCC(NC)c1cccc(-c2cc(C)c(C)cc2C)c1
InChIInChI=1S/C19H25N/c1-6-19(20-5)17-9-7-8-16(12-17)18-11-14(3)13(2)10-15(18)4/h7-12,19-20H,6H2,1-5H3
InChIKeyWDOBUUUIEVJZRV-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.95
Rot. Bonds4

About N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine

N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine (PubChem CID 64984941) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine.

Molecular Properties

Compound NameN-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine
PubChem CID64984941
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC NameN-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine
SMILESCCC(NC)c1cccc(-c2cc(C)c(C)cc2C)c1
InChIInChI=1S/C19H25N/c1-6-19(20-5)17-9-7-8-16(12-17)18-11-14(3)13(2)10-15(18)4/h7-12,19-20H,6H2,1-5H3
InChIKeyWDOBUUUIEVJZRV-UHFFFAOYSA-N
XLogP4.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[3-(3,4-dimethylphenyl)phenyl]-N-methylpropan-1-amine
CID 63424535
N-methyl-1-[3-(4-methyl-3-pyridinyl)phenyl]propan-1-amine
CID 66271239
N-methyl-1-(3-phenylphenyl)propan-1-amine
CID 54912079
N-methyl-1-[3-(2-methylthiophen-3-yl)phenyl]propan-1-amine
CID 102834501
1-[3-(2,4-difluorophenyl)phenyl]-N-methylpropan-1-amine
CID 61033126
1-[3-(1,3-dimethylpyrazol-4-yl)phenyl]-N-methylpropan-1-amine
CID 66007870
1-[3-(2-methoxy-4,6-dimethylphenyl)phenyl]-N-methylpropan-1-amine
CID 106681161
N-methyl-1-(3-pyridin-3-ylphenyl)propan-1-amine
CID 54911968
3-[3-[1-(methylamino)propyl]phenyl]benzonitrile
CID 54911796
1-[3-(3-fluoro-4-methoxyphenyl)phenyl]-N-methylpropan-1-amine
CID 61033554
1-[3-(2,4-difluoro-5-methylphenyl)phenyl]-N-ethylpropan-1-amine
CID 79735816
N-methyl-3-[1-(methylamino)propyl]aniline
CID 116951935

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine?
The IUPAC name of N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine (CID 64984941) is N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine.
What is the SMILES notation for N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine?
The canonical SMILES for N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine is CCC(NC)c1cccc(-c2cc(C)c(C)cc2C)c1.
What is the InChIKey of N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine?
The InChIKey is WDOBUUUIEVJZRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-6-19(20-5)17-9-7-8-16(12-17)18-11-14(3)13(2)10-15(18)4/h7-12,19-20H,6H2,1-5H3.
What are the key properties of N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine?
N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine has a molecular weight of 267.42 g/mol, XLogP of 4.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[3-(2,4,5-trimethylphenyl)phenyl]propan-1-amine is sourced from PubChem (CID 64984941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).