3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine

C16H21N3O — CID 81246879

IUPAC3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine
SMILESCCNCc1cnccc1N(C)c1cccc(OC)c1
InChIInChI=1S/C16H21N3O/c1-4-17-11-13-12-18-9-8-16(13)19(2)14-6-5-7-15(10-14)20-3/h5-10,12,17H,4,11H2,1-3H3
InChIKeyDIJWQBOPBBTVFE-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.97
Rot. Bonds6

About 3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine

3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine (PubChem CID 81246879) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine.

Molecular Properties

Compound Name3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine
PubChem CID81246879
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine
SMILESCCNCc1cnccc1N(C)c1cccc(OC)c1
InChIInChI=1S/C16H21N3O/c1-4-17-11-13-12-18-9-8-16(13)19(2)14-6-5-7-15(10-14)20-3/h5-10,12,17H,4,11H2,1-3H3
InChIKeyDIJWQBOPBBTVFE-UHFFFAOYSA-N
XLogP2.97
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-3-amine
CID 105073319
3-(ethylaminomethyl)-N-[(4-methoxyphenyl)methyl]-N-methylpyridin-4-amine
CID 81249417
5-chloro-4-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-2-amine
CID 114925895
2-chloro-4-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylaniline
CID 81143432
N-(2,4-dimethylphenyl)-3-(ethylaminomethyl)-N-methylpyridin-4-amine
CID 81246461
N-(3,5-dimethylphenyl)-4-(ethylaminomethyl)-N-methylpyridin-3-amine
CID 105073467
N-(4-methoxyphenyl)-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81249525
3-(ethylaminomethyl)-N-methyl-N-[(2-methylphenyl)methyl]pyridin-4-amine
CID 81246615
3-(ethylaminomethyl)-N-methyl-N-(2-phenylethyl)pyridin-4-amine
CID 81248283
2-N-ethyl-2-N-[3-(ethylaminomethyl)-4-pyridinyl]-1-N,1-N-dimethylpropane-1,2-diamine
CID 103191478
2-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylaniline
CID 63785861
1-N,1-N,4-N,4-N-tetrakis(3-methoxyphenyl)benzene-1,4-diamine
CID 22900292

Frequently Asked Questions

What is the IUPAC name of 3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine?
The IUPAC name of 3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine (CID 81246879) is 3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine.
What is the SMILES notation for 3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine?
The canonical SMILES for 3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine is CCNCc1cnccc1N(C)c1cccc(OC)c1.
What is the InChIKey of 3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine?
The InChIKey is DIJWQBOPBBTVFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-4-17-11-13-12-18-9-8-16(13)19(2)14-6-5-7-15(10-14)20-3/h5-10,12,17H,4,11H2,1-3H3.
What are the key properties of 3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine?
3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine has a molecular weight of 271.36 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylaminomethyl)-N-(3-methoxyphenyl)-N-methylpyridin-4-amine is sourced from PubChem (CID 81246879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).