N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine

C19H25N — CID 43103422

IUPACN-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine
SMILESCc1ccc(CNC(C)c2cc(C)c(C)cc2C)cc1
InChIInChI=1S/C19H25N/c1-13-6-8-18(9-7-13)12-20-17(5)19-11-15(3)14(2)10-16(19)4/h6-11,17,20H,12H2,1-5H3
InChIKeyBRVCPEUTJPSSNH-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.77
Rot. Bonds4

About N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine

N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine (PubChem CID 43103422) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine.

Molecular Properties

Compound NameN-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine
PubChem CID43103422
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC NameN-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine
SMILESCc1ccc(CNC(C)c2cc(C)c(C)cc2C)cc1
InChIInChI=1S/C19H25N/c1-13-6-8-18(9-7-13)12-20-17(5)19-11-15(3)14(2)10-16(19)4/h6-11,17,20H,12H2,1-5H3
InChIKeyBRVCPEUTJPSSNH-UHFFFAOYSA-N
XLogP4.77
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 ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,5-dimethylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]ethanamine
CID 64686932
4-[[1-(2,4-dimethylphenyl)ethylamino]methyl]-N,N-dimethylaniline
CID 43108017
4-[[1-(2,5-dimethylphenyl)ethylamino]methyl]-N,N-dimethylaniline
CID 43081375
1-(2,5-dimethylphenyl)-N-[(4-ethoxyphenyl)methyl]ethanamine
CID 43221696
1-(2-chlorophenyl)-N-[(4-methylphenyl)methyl]ethanamine
CID 22483034
1-(2,4-dimethylphenyl)-N-[(2,4,6-trimethylphenyl)methyl]ethanamine
CID 18767185
N-[(3,4-dichlorophenyl)methyl]-1-(2,4-dimethylphenyl)ethanamine
CID 63449103
1-(2-methoxy-5-methylphenyl)-N-[(4-methoxyphenyl)methyl]ethanamine
CID 43178128
N-[(2-bromophenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine
CID 63454939
N-(thiophen-2-ylmethyl)-1-(2,4,5-trimethylphenyl)ethanamine
CID 43106256
[4-[[1-(2-methoxy-4-methylphenyl)ethylamino]methyl]phenyl]methanol
CID 107230187
(1R)-N-[(4-ethylphenyl)methyl]-1-(4-methylphenyl)ethanamine
CID 81350057

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine?
The IUPAC name of N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine (CID 43103422) is N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine.
What is the SMILES notation for N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine?
The canonical SMILES for N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine is Cc1ccc(CNC(C)c2cc(C)c(C)cc2C)cc1.
What is the InChIKey of N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine?
The InChIKey is BRVCPEUTJPSSNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-13-6-8-18(9-7-13)12-20-17(5)19-11-15(3)14(2)10-16(19)4/h6-11,17,20H,12H2,1-5H3.
What are the key properties of N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine?
N-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine has a molecular weight of 267.42 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-[(4-methylphenyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine is sourced from PubChem (CID 43103422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).