[2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol

C7H12N2O — CID 169243513

IUPAC[2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol
SMILESNCC1C=CC(CO)=CN1
InChIInChI=1S/C7H12N2O/c8-3-7-2-1-6(5-10)4-9-7/h1-2,4,7,9-10H,3,5,8H2
InChIKeyKYOKOLCXZYYSJG-UHFFFAOYSA-N
MW140.19 g/mol
LogP-0.65
Rot. Bonds2

About [2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol

[2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol (PubChem CID 169243513) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is [2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol.

Molecular Properties

Compound Name[2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol
PubChem CID169243513
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name[2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol
SMILESNCC1C=CC(CO)=CN1
InChIInChI=1S/C7H12N2O/c8-3-7-2-1-6(5-10)4-9-7/h1-2,4,7,9-10H,3,5,8H2
InChIKeyKYOKOLCXZYYSJG-UHFFFAOYSA-N
XLogP-0.65
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze [2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(Trifluoromethyl)-1,2-dihydropyridin-4-yl]methanol
CID 164602683
1,2-Dihydropyridin-5-ylmethanol
CID 19045944
Amino-(2-ethyl-1,2-dihydropyridin-5-yl)methanol
CID 129199789
(2R)-2-amino-2-(2-methyl-1,2-dihydropyridin-5-yl)ethanol
CID 130389428
[2-(aminomethyl)-1-methyl-2H-pyridin-5-yl]methanol
CID 142209814
1,2-Dihydropyridin-5-yl(phosphanyl)methanol
CID 155207299
(4-Amino-1,2-dihydropyridin-5-yl)methanol
CID 86340427
(6-Amino-2-methyl-1,2-dihydropyridin-5-yl)methanol
CID 86341715
1-(2-Methyl-1,2-dihydropyridin-5-yl)ethanol
CID 130802511
(2-Methyl-1,2-dihydropyridin-5-yl)methanol
CID 143687161

Frequently Asked Questions

What is the IUPAC name of [2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol?
The IUPAC name of [2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol (CID 169243513) is [2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol.
What is the SMILES notation for [2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol?
The canonical SMILES for [2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol is NCC1C=CC(CO)=CN1.
What is the InChIKey of [2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol?
The InChIKey is KYOKOLCXZYYSJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c8-3-7-2-1-6(5-10)4-9-7/h1-2,4,7,9-10H,3,5,8H2.
What are the key properties of [2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol?
[2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol has a molecular weight of 140.19 g/mol, XLogP of -0.65, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)-1,2-dihydropyridin-5-yl]methanol is sourced from PubChem (CID 169243513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).