4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine

C14H16N2O — CID 171854790

IUPAC4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine
SMILESCCc1cc(N)ncc1-c1cccc(OC)c1
InChIInChI=1S/C14H16N2O/c1-3-10-8-14(15)16-9-13(10)11-5-4-6-12(7-11)17-2/h4-9H,3H2,1-2H3,(H2,15,16)
InChIKeyNDBJVDQNZRYYDN-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.90
Rot. Bonds3

About 4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine

4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine (PubChem CID 171854790) has the molecular formula C14H16N2O and a molecular weight of 228.29 g/mol. Its IUPAC name is 4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine.

Molecular Properties

Compound Name4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine
PubChem CID171854790
Molecular FormulaC14H16N2O
Molecular Weight228.29 g/mol
Exact Mass228.13
IUPAC Name4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine
SMILESCCc1cc(N)ncc1-c1cccc(OC)c1
InChIInChI=1S/C14H16N2O/c1-3-10-8-14(15)16-9-13(10)11-5-4-6-12(7-11)17-2/h4-9H,3H2,1-2H3,(H2,15,16)
InChIKeyNDBJVDQNZRYYDN-UHFFFAOYSA-N
XLogP2.90
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine?
The IUPAC name of 4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine (CID 171854790) is 4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine.
What is the SMILES notation for 4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine?
The canonical SMILES for 4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine is CCc1cc(N)ncc1-c1cccc(OC)c1.
What is the InChIKey of 4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine?
The InChIKey is NDBJVDQNZRYYDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-3-10-8-14(15)16-9-13(10)11-5-4-6-12(7-11)17-2/h4-9H,3H2,1-2H3,(H2,15,16).
What are the key properties of 4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine?
4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine has a molecular weight of 228.29 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-(3-methoxyphenyl)pyridin-2-amine is sourced from PubChem (CID 171854790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).