N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine

C17H22N2 — CID 55165244

IUPACN-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
SMILESCCNC(c1ccc(CC)cc1)c1ccc(C)nc1
InChIInChI=1S/C17H22N2/c1-4-14-7-10-15(11-8-14)17(18-5-2)16-9-6-13(3)19-12-16/h6-12,17-18H,4-5H2,1-3H3
InChIKeyKRGMSYLYLVERTD-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.65
Rot. Bonds5

About N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine

N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine (PubChem CID 55165244) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
PubChem CID55165244
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC NameN-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
SMILESCCNC(c1ccc(CC)cc1)c1ccc(C)nc1
InChIInChI=1S/C17H22N2/c1-4-14-7-10-15(11-8-14)17(18-5-2)16-9-6-13(3)19-12-16/h6-12,17-18H,4-5H2,1-3H3
InChIKeyKRGMSYLYLVERTD-UHFFFAOYSA-N
XLogP3.65
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(6-methyl-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine
CID 105144382
N-[bis(4-ethylphenyl)methyl]ethanamine
CID 43491437
N-[(6-methyl-3-pyridinyl)-pyrimidin-5-ylmethyl]ethanamine
CID 105118897
N-[(6-methyl-3-pyridinyl)-naphthalen-2-ylmethyl]ethanamine
CID 63155569
N-[(4-fluoro-3-methylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 63155426
N-[(4-ethylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine
CID 55221471
N-[(3-iodophenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 115854960
N-[(4-bromo-3,5-dimethylphenyl)-(4-ethylphenyl)methyl]ethanamine
CID 114330651
N-ethyl-1-(6-methyl-3-pyridinyl)ethanamine
CID 63155732
N-[(4-ethylthiadiazol-5-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 105146355
N-[(2,3-dichlorophenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 115854889
N-[(3,4-dichlorophenyl)-(4-ethylphenyl)methyl]ethanamine
CID 43491461

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine (CID 55165244) is N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine is CCNC(c1ccc(CC)cc1)c1ccc(C)nc1.
What is the InChIKey of N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
The InChIKey is KRGMSYLYLVERTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-4-14-7-10-15(11-8-14)17(18-5-2)16-9-6-13(3)19-12-16/h6-12,17-18H,4-5H2,1-3H3.
What are the key properties of N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine has a molecular weight of 254.38 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 55165244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).