5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine

C17H23N3O — CID 80638739

IUPAC5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine
SMILESCCNCc1cnc(N(C)c2ccc(OC)cc2)c(C)c1
InChIInChI=1S/C17H23N3O/c1-5-18-11-14-10-13(2)17(19-12-14)20(3)15-6-8-16(21-4)9-7-15/h6-10,12,18H,5,11H2,1-4H3
InChIKeyNUKPPXSMLZHCAX-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.28
Rot. Bonds6

About 5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine

5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine (PubChem CID 80638739) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine
PubChem CID80638739
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine
SMILESCCNCc1cnc(N(C)c2ccc(OC)cc2)c(C)c1
InChIInChI=1S/C17H23N3O/c1-5-18-11-14-10-13(2)17(19-12-14)20(3)15-6-8-16(21-4)9-7-15/h6-10,12,18H,5,11H2,1-4H3
InChIKeyNUKPPXSMLZHCAX-UHFFFAOYSA-N
XLogP3.28
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N-methylpyridin-2-amine
CID 62293024
5-(ethylaminomethyl)-N-(4-fluorophenyl)-N,3-dimethylpyridin-2-amine
CID 80635720
N,3-dimethyl-N-(4-methylphenyl)-5-(propylaminomethyl)pyridin-2-amine
CID 80636506
3-chloro-N-(4-methoxyphenyl)-N-methyl-5-(methylaminomethyl)pyridin-2-amine
CID 62294086
2-chloro-4-(ethylaminomethyl)-N-(4-methoxyphenyl)-N-methylaniline
CID 81143433
N-butan-2-yl-5-(ethylaminomethyl)-N-(2-methoxyethyl)-3-methylpyridin-2-amine
CID 80630535
N'-ethyl-N'-[5-(ethylaminomethyl)-3-methyl-2-pyridinyl]-N,N-dimethylpropane-1,3-diamine
CID 102995270
5-(ethylaminomethyl)-N-(1-ethylpiperidin-4-yl)-N,3-dimethylpyridin-2-amine
CID 80639174
N-ethyl-5-(ethylaminomethyl)-N-(3-fluorophenyl)-3-methylpyridin-2-amine
CID 80637668
5-(aminomethyl)-N,3-dimethyl-N-phenylpyridin-2-amine
CID 79884611
6-(4-ethyl-N-methylanilino)-5-methylpyridine-3-carbaldehyde
CID 80636648
N-[[6-(4-methoxyphenyl)sulfanyl-3-pyridinyl]methyl]ethanamine
CID 80639477

Frequently Asked Questions

What is the IUPAC name of 5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine?
The IUPAC name of 5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine (CID 80638739) is 5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine.
What is the SMILES notation for 5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine?
The canonical SMILES for 5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine is CCNCc1cnc(N(C)c2ccc(OC)cc2)c(C)c1.
What is the InChIKey of 5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine?
The InChIKey is NUKPPXSMLZHCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-5-18-11-14-10-13(2)17(19-12-14)20(3)15-6-8-16(21-4)9-7-15/h6-10,12,18H,5,11H2,1-4H3.
What are the key properties of 5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine?
5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine has a molecular weight of 285.39 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-N-(4-methoxyphenyl)-N,3-dimethylpyridin-2-amine is sourced from PubChem (CID 80638739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).