(2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol

C7H12N2O — CID 86341003

IUPAC(2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol
SMILESCC1=C(CO)C(N)NC=C1
InChIInChI=1S/C7H12N2O/c1-5-2-3-9-7(8)6(5)4-10/h2-3,7,9-10H,4,8H2,1H3
InChIKeyJOBHIJYZJDXRME-UHFFFAOYSA-N
MW140.19 g/mol
LogP-0.30
Rot. Bonds1

About (2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol

(2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol (PubChem CID 86341003) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is (2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol.

Molecular Properties

Compound Name(2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol
PubChem CID86341003
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name(2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol
SMILESCC1=C(CO)C(N)NC=C1
InChIInChI=1S/C7H12N2O/c1-5-2-3-9-7(8)6(5)4-10/h2-3,7,9-10H,4,8H2,1H3
InChIKeyJOBHIJYZJDXRME-UHFFFAOYSA-N
XLogP-0.30
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

[2-amino-2-(dimethylamino)-1H-pyridin-3-yl]methanol
CID 70418693
[2-(Methylamino)-1,2-dihydropyridin-3-yl]methanol
CID 86340421
3-Methyl-1,2-dihydropyridin-2-ol
CID 89049434
4-(Aminomethyl)-3-methyl-1,2-dihydropyridin-2-ol
CID 141021566
1,2-Dihydropyridin-3-ylmethanol
CID 145531892
(2-Amino-1,2-dihydropyridin-3-yl)methanol
CID 173058001
(6-Amino-4-methyl-1,2-dihydropyridin-3-yl)methanol
CID 86341004
[2-(Dimethylamino)-1,2-dihydropyridin-3-yl]methanol
CID 86341008
[2-(Dimethylamino)-1,2-dihydropyridin-4-yl]methanol
CID 86341275
(2-Amino-5-methyl-1,2-dihydropyridin-3-yl)methanol
CID 168202456

Frequently Asked Questions

What is the IUPAC name of (2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol?
The IUPAC name of (2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol (CID 86341003) is (2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol.
What is the SMILES notation for (2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol?
The canonical SMILES for (2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol is CC1=C(CO)C(N)NC=C1.
What is the InChIKey of (2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol?
The InChIKey is JOBHIJYZJDXRME-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-5-2-3-9-7(8)6(5)4-10/h2-3,7,9-10H,4,8H2,1H3.
What are the key properties of (2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol?
(2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol has a molecular weight of 140.19 g/mol, XLogP of -0.30, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-4-methyl-1,2-dihydropyridin-3-yl)methanol is sourced from PubChem (CID 86341003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).