2,3-dihydropyridin-5-ylmethanamine

C6H10N2 — CID 123776604

IUPAC2,3-dihydropyridin-5-ylmethanamine
SMILESNCC1=CCCN=C1
InChIInChI=1S/C6H10N2/c7-4-6-2-1-3-8-5-6/h2,5H,1,3-4,7H2
InChIKeyLBHFUQOEBGLBDN-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.35
Rot. Bonds1

About 2,3-dihydropyridin-5-ylmethanamine

2,3-dihydropyridin-5-ylmethanamine (PubChem CID 123776604) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 2,3-dihydropyridin-5-ylmethanamine.

Molecular Properties

Compound Name2,3-dihydropyridin-5-ylmethanamine
PubChem CID123776604
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name2,3-dihydropyridin-5-ylmethanamine
SMILESNCC1=CCCN=C1
InChIInChI=1S/C6H10N2/c7-4-6-2-1-3-8-5-6/h2,5H,1,3-4,7H2
InChIKeyLBHFUQOEBGLBDN-UHFFFAOYSA-N
XLogP0.35
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(Z)-2-(aminomethyl)-N-methylpent-2-enimidoyl fluoride
CID 162683362
5-Methyl-2,3-dihydropyridine
CID 53854191
3H-pyridin-1-ium-5-ylmethanamine
CID 57056736
2H-pyrrol-4-ylmethanamine
CID 59569436
(2-methyl-2H-pyrrol-4-yl)methanamine
CID 68322392
5-Ethyl-2,3-dihydropyridine
CID 68387499
3-methylidene-2H-pyridin-2-amine
CID 68545375
[(2S)-2-methyl-2H-pyrrol-4-yl]methanamine
CID 89038970
5-Methyl-2,3-dihydropyridin-2-amine
CID 89227049
(3-Methyl-2,3-dihydropyridin-5-yl)methanamine
CID 89272014
1-(2,3-dihydropyridin-5-yl)-N-methylmethanamine
CID 89652924
2,3-Dihydropyridin-4-ylmethanamine
CID 90137212

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydropyridin-5-ylmethanamine?
The IUPAC name of 2,3-dihydropyridin-5-ylmethanamine (CID 123776604) is 2,3-dihydropyridin-5-ylmethanamine.
What is the SMILES notation for 2,3-dihydropyridin-5-ylmethanamine?
The canonical SMILES for 2,3-dihydropyridin-5-ylmethanamine is NCC1=CCCN=C1.
What is the InChIKey of 2,3-dihydropyridin-5-ylmethanamine?
The InChIKey is LBHFUQOEBGLBDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c7-4-6-2-1-3-8-5-6/h2,5H,1,3-4,7H2.
What are the key properties of 2,3-dihydropyridin-5-ylmethanamine?
2,3-dihydropyridin-5-ylmethanamine has a molecular weight of 110.16 g/mol, XLogP of 0.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydropyridin-5-ylmethanamine is sourced from PubChem (CID 123776604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).