2-(2,3-dihydropyridin-3-yl)ethanamine

C7H12N2 — CID 123473554

IUPAC2-(2,3-dihydropyridin-3-yl)ethanamine
SMILESNCCC1C=CC=NC1
InChIInChI=1S/C7H12N2/c8-4-3-7-2-1-5-9-6-7/h1-2,5,7H,3-4,6,8H2
InChIKeyGVDYRVAKYSYACH-UHFFFAOYSA-N
MW124.19 g/mol
LogP0.59
Rot. Bonds2

About 2-(2,3-dihydropyridin-3-yl)ethanamine

2-(2,3-dihydropyridin-3-yl)ethanamine (PubChem CID 123473554) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 2-(2,3-dihydropyridin-3-yl)ethanamine.

Molecular Properties

Compound Name2-(2,3-dihydropyridin-3-yl)ethanamine
PubChem CID123473554
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name2-(2,3-dihydropyridin-3-yl)ethanamine
SMILESNCCC1C=CC=NC1
InChIInChI=1S/C7H12N2/c8-4-3-7-2-1-5-9-6-7/h1-2,5,7H,3-4,6,8H2
InChIKeyGVDYRVAKYSYACH-UHFFFAOYSA-N
XLogP0.59
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-Dihydropyridin-2-amine
CID 18669108
3-Ethyl-2,3-dihydropyridine
CID 54500796
2,3-Dihydropyridin-2-ylmethanamine
CID 66665484
3-Ethyl-2,3-dihydropyridin-2-amine
CID 68013886
2-(2,3-dihydropyridin-3-yl)-N-methylethanamine
CID 123156694
3-Methyl-2,3-dihydropyridin-2-amine
CID 124028194
(2S)-4-ethenyl-2,3-dihydropyridin-2-amine
CID 124095550
3-Prop-2-enyl-2,3-dihydropyridine
CID 129171622
2-Azabicyclo[4.1.0]hepta-2,4-dien-1-amine
CID 139493391
[(3R)-2,3-dihydropyridin-3-yl]methanamine
CID 146662318
3-ethyl-2H-pyridine-2,3-diamine
CID 154321895
3-Ethyl-6-methyl-2,3-dihydropyridin-2-amine
CID 156232545

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydropyridin-3-yl)ethanamine?
The IUPAC name of 2-(2,3-dihydropyridin-3-yl)ethanamine (CID 123473554) is 2-(2,3-dihydropyridin-3-yl)ethanamine.
What is the SMILES notation for 2-(2,3-dihydropyridin-3-yl)ethanamine?
The canonical SMILES for 2-(2,3-dihydropyridin-3-yl)ethanamine is NCCC1C=CC=NC1.
What is the InChIKey of 2-(2,3-dihydropyridin-3-yl)ethanamine?
The InChIKey is GVDYRVAKYSYACH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c8-4-3-7-2-1-5-9-6-7/h1-2,5,7H,3-4,6,8H2.
What are the key properties of 2-(2,3-dihydropyridin-3-yl)ethanamine?
2-(2,3-dihydropyridin-3-yl)ethanamine has a molecular weight of 124.19 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydropyridin-3-yl)ethanamine is sourced from PubChem (CID 123473554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).