1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine

C17H22N2 — CID 82730774

IUPAC1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine
SMILESCCc1cccnc1C(NC)c1ccc(C)c(C)c1
InChIInChI=1S/C17H22N2/c1-5-14-7-6-10-19-17(14)16(18-4)15-9-8-12(2)13(3)11-15/h6-11,16,18H,5H2,1-4H3
InChIKeyLZVGLKDKNROKFH-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.57
Rot. Bonds4

About 1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine

1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine (PubChem CID 82730774) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine
PubChem CID82730774
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine
SMILESCCc1cccnc1C(NC)c1ccc(C)c(C)c1
InChIInChI=1S/C17H22N2/c1-5-14-7-6-10-19-17(14)16(18-4)15-9-8-12(2)13(3)11-15/h6-11,16,18H,5H2,1-4H3
InChIKeyLZVGLKDKNROKFH-UHFFFAOYSA-N
XLogP3.57
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 ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine
CID 82731318
N-[(3-chloro-4-methylphenyl)-(3-ethyl-2-pyridinyl)methyl]ethanamine
CID 107560643
1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine
CID 82732624
1-(3-ethyl-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine
CID 82730091
1-(3-ethyl-2-pyridinyl)-1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
CID 82729981
1-(3-ethyl-2-pyridinyl)-N-methyl-1-(7-methyl-1-benzofuran-2-yl)methanamine
CID 114730705
1-(3-ethyl-2-pyridinyl)-N-methyl-1-(5-propoxy-3-pyridinyl)methanamine
CID 82732602
1-(3,4-dimethylphenyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 105031923
1-(3-chloro-4-methylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine
CID 107560238
N-[(3,4-dimethylphenyl)-(2-methyl-3-pyridinyl)methyl]ethanamine
CID 105140352
1-(3,4-dimethylphenyl)-1-(3-ethylphenyl)-N-methylmethanamine
CID 105018579
N-[(3-ethyl-2-pyridinyl)-(4-propan-2-ylphenyl)methyl]ethanamine
CID 82732767

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine?
The IUPAC name of 1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine (CID 82730774) is 1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine?
The canonical SMILES for 1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine is CCc1cccnc1C(NC)c1ccc(C)c(C)c1.
What is the InChIKey of 1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine?
The InChIKey is LZVGLKDKNROKFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-5-14-7-6-10-19-17(14)16(18-4)15-9-8-12(2)13(3)11-15/h6-11,16,18H,5H2,1-4H3.
What are the key properties of 1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine?
1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine has a molecular weight of 254.38 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine is sourced from PubChem (CID 82730774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).