2-ethyl-1,2-dihydropyridin-3-amine

C7H12N2 — CID 19698535

IUPAC2-ethyl-1,2-dihydropyridin-3-amine
SMILESCCC1NC=CC=C1N
InChIInChI=1S/C7H12N2/c1-2-7-6(8)4-3-5-9-7/h3-5,7,9H,2,8H2,1H3
InChIKeyXXUDIROVYOYMNM-UHFFFAOYSA-N
MW124.19 g/mol
LogP0.72
Rot. Bonds1

About 2-ethyl-1,2-dihydropyridin-3-amine

2-ethyl-1,2-dihydropyridin-3-amine (PubChem CID 19698535) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 2-ethyl-1,2-dihydropyridin-3-amine.

Molecular Properties

Compound Name2-ethyl-1,2-dihydropyridin-3-amine
PubChem CID19698535
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name2-ethyl-1,2-dihydropyridin-3-amine
SMILESCCC1NC=CC=C1N
InChIInChI=1S/C7H12N2/c1-2-7-6(8)4-3-5-9-7/h3-5,7,9H,2,8H2,1H3
InChIKeyXXUDIROVYOYMNM-UHFFFAOYSA-N
XLogP0.72
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1,2-dihydropyridin-3-amine?
The IUPAC name of 2-ethyl-1,2-dihydropyridin-3-amine (CID 19698535) is 2-ethyl-1,2-dihydropyridin-3-amine.
What is the SMILES notation for 2-ethyl-1,2-dihydropyridin-3-amine?
The canonical SMILES for 2-ethyl-1,2-dihydropyridin-3-amine is CCC1NC=CC=C1N.
What is the InChIKey of 2-ethyl-1,2-dihydropyridin-3-amine?
The InChIKey is XXUDIROVYOYMNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-2-7-6(8)4-3-5-9-7/h3-5,7,9H,2,8H2,1H3.
What are the key properties of 2-ethyl-1,2-dihydropyridin-3-amine?
2-ethyl-1,2-dihydropyridin-3-amine has a molecular weight of 124.19 g/mol, XLogP of 0.72, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1,2-dihydropyridin-3-amine is sourced from PubChem (CID 19698535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).