N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine

C17H22N2 — CID 115854963

IUPACN-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
SMILESCCNC(c1ccc(C)nc1)c1ccc(C)cc1C
InChIInChI=1S/C17H22N2/c1-5-18-17(15-8-7-14(4)19-11-15)16-9-6-12(2)10-13(16)3/h6-11,17-18H,5H2,1-4H3
InChIKeyJDHJEXZYWBPPOP-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.71
Rot. Bonds4

About N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine

N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine (PubChem CID 115854963) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
PubChem CID115854963
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC NameN-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
SMILESCCNC(c1ccc(C)nc1)c1ccc(C)cc1C
InChIInChI=1S/C17H22N2/c1-5-18-17(15-8-7-14(4)19-11-15)16-9-6-12(2)10-13(16)3/h6-11,17-18H,5H2,1-4H3
InChIKeyJDHJEXZYWBPPOP-UHFFFAOYSA-N
XLogP3.71
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,4-dimethylphenyl)-(4-ethylphenyl)methyl]ethanamine
CID 43489966
N-[(2,3-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 115854598
N-[(4-bromo-2-methylphenyl)-(6-methyl-3-pyridinyl)methyl]propan-1-amine
CID 115854745
N-[(4-fluoro-3-methylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 63155426
N-[(2,4-dimethylphenyl)-(3-methoxy-4-methylphenyl)methyl]ethanamine
CID 43489971
N-[(2-bromo-5-methylphenyl)-(6-methyl-3-pyridinyl)methyl]propan-1-amine
CID 115854714
N-[(6-methyl-3-pyridinyl)-pyrimidin-5-ylmethyl]ethanamine
CID 105118897
N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 55165244
N-[(3-chloro-5-methylphenyl)-(2,4-dimethylphenyl)methyl]ethanamine
CID 81324084
N-[(5-bromo-2-pyridinyl)-(2,4-dimethylphenyl)methyl]ethanamine
CID 115606105
N-[(6-methyl-3-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]ethanamine
CID 115854580
N-[(2,3-dichlorophenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 115854889

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine (CID 115854963) is N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine is CCNC(c1ccc(C)nc1)c1ccc(C)cc1C.
What is the InChIKey of N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
The InChIKey is JDHJEXZYWBPPOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-5-18-17(15-8-7-14(4)19-11-15)16-9-6-12(2)10-13(16)3/h6-11,17-18H,5H2,1-4H3.
What are the key properties of N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine has a molecular weight of 254.38 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 115854963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).