N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine

C15H18N2O3 — CID 75430755

IUPACN-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine
SMILESCOc1ccncc1NCc1cccc(OC)c1OC
InChIInChI=1S/C15H18N2O3/c1-18-13-7-8-16-10-12(13)17-9-11-5-4-6-14(19-2)15(11)20-3/h4-8,10,17H,9H2,1-3H3
InChIKeySUSANQPNWJDKQB-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.72
Rot. Bonds6

About N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine

N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine (PubChem CID 75430755) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine.

Molecular Properties

Compound NameN-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine
PubChem CID75430755
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC NameN-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine
SMILESCOc1ccncc1NCc1cccc(OC)c1OC
InChIInChI=1S/C15H18N2O3/c1-18-13-7-8-16-10-12(13)17-9-11-5-4-6-14(19-2)15(11)20-3/h4-8,10,17H,9H2,1-3H3
InChIKeySUSANQPNWJDKQB-UHFFFAOYSA-N
XLogP2.72
TPSA52.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyridin-3-amine
CID 63329305
N-[(2,3-dimethoxyphenyl)methyl]-1,5-dimethylpyrazol-4-amine
CID 19625828
N-[(3-ethoxy-2-methoxyphenyl)methyl]-2-methoxyaniline
CID 43757786
N-[(2,3-dimethoxyphenyl)methyl]-6-fluoropyridin-3-amine
CID 103825857
N-(isoquinolin-4-ylmethyl)-2-methoxyaniline
CID 115884033
3-(aminomethyl)-N-[(2-methoxyphenyl)methyl]pyridin-4-amine
CID 115045042
N-[(2,3-dimethoxyphenyl)methyl]-4-methylaniline
CID 4143681
N-[(2,3-dimethoxyphenyl)methyl]hydroxylamine
CID 11572077
N-[(5-bromo-2-methoxyphenyl)methyl]isoquinolin-5-amine
CID 43229368
2-bromo-N-[(2,3-dimethoxyphenyl)methyl]-5-methylaniline
CID 82761585
4-chloro-N-[(2,3-dimethoxyphenyl)methyl]-2-fluoroaniline
CID 43716521
4-tert-butyl-N-[(2,3-dimethoxyphenyl)methyl]aniline
CID 39422649

Frequently Asked Questions

What is the IUPAC name of N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine?
The IUPAC name of N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine (CID 75430755) is N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine.
What is the SMILES notation for N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine?
The canonical SMILES for N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine is COc1ccncc1NCc1cccc(OC)c1OC.
What is the InChIKey of N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine?
The InChIKey is SUSANQPNWJDKQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-18-13-7-8-16-10-12(13)17-9-11-5-4-6-14(19-2)15(11)20-3/h4-8,10,17H,9H2,1-3H3.
What are the key properties of N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine?
N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine has a molecular weight of 274.32 g/mol, XLogP of 2.72, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,3-dimethoxyphenyl)methyl]-4-methoxypyridin-3-amine is sourced from PubChem (CID 75430755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).