3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine

C12H14N2O — CID 86341477

IUPAC3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine
SMILESCOc1ccc(C2=C(N)C=CNC2)cc1
InChIInChI=1S/C12H14N2O/c1-15-10-4-2-9(3-5-10)11-8-14-7-6-12(11)13/h2-7,14H,8,13H2,1H3
InChIKeyDJKGNWKUNFNUCR-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.48
Rot. Bonds2

About 3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine

3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine (PubChem CID 86341477) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine
PubChem CID86341477
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine
SMILESCOc1ccc(C2=C(N)C=CNC2)cc1
InChIInChI=1S/C12H14N2O/c1-15-10-4-2-9(3-5-10)11-8-14-7-6-12(11)13/h2-7,14H,8,13H2,1H3
InChIKeyDJKGNWKUNFNUCR-UHFFFAOYSA-N
XLogP1.48
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-fluorophenyl)-1,2-dihydropyridin-4-amine
CID 86341374
1-methoxy-4-[2-(4-methoxyphenyl)cyclopropen-1-yl]benzene
CID 86037545
1-methoxy-4-[2-(4-methoxyphenyl)cyclopenta-1,3-dien-1-yl]benzene
CID 15519665
1-methoxy-4-(2-phenylcyclopenten-1-yl)benzene
CID 13444266
4-(4-methoxyphenyl)-3-phenyl-1,2-dihydropyrrol-5-one
CID 56649060
ethane;4-methoxyaniline
CID 144603339
4-methoxyaniline;hydrobromide
CID 518270
4-(4-methoxyphenyl)pyridin-1-ium
CID 132526001
2-(4-methoxyphenyl)-1H-azirine
CID 19098652
5-amino-4-(4-methoxyphenyl)-3H-1,3-thiazole-2-thione
CID 28805707
1-(113C)methoxy-4-methylbenzene
CID 166176950
4-(4-methoxyphenyl)-1H-indazol-3-amine
CID 118046988

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine?
The IUPAC name of 3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine (CID 86341477) is 3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine.
What is the SMILES notation for 3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine?
The canonical SMILES for 3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine is COc1ccc(C2=C(N)C=CNC2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine?
The InChIKey is DJKGNWKUNFNUCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-15-10-4-2-9(3-5-10)11-8-14-7-6-12(11)13/h2-7,14H,8,13H2,1H3.
What are the key properties of 3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine?
3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine has a molecular weight of 202.26 g/mol, XLogP of 1.48, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-1,2-dihydropyridin-4-amine is sourced from PubChem (CID 86341477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).