2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid

C8H10N2O3 — CID 55293543

IUPAC2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid
SMILESNC(CO)c1ncccc1C(=O)O
InChIInChI=1S/C8H10N2O3/c9-6(4-11)7-5(8(12)13)2-1-3-10-7/h1-3,6,11H,4,9H2,(H,12,13)
InChIKeyRDVVWBMTOYQUTA-UHFFFAOYSA-N
MW182.18 g/mol
LogP-0.23
Rot. Bonds3

About 2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid

2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid (PubChem CID 55293543) has the molecular formula C8H10N2O3 and a molecular weight of 182.18 g/mol. Its IUPAC name is 2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid
PubChem CID55293543
Molecular FormulaC8H10N2O3
Molecular Weight182.18 g/mol
Exact Mass182.07
IUPAC Name2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid
SMILESNC(CO)c1ncccc1C(=O)O
InChIInChI=1S/C8H10N2O3/c9-6(4-11)7-5(8(12)13)2-1-3-10-7/h1-3,6,11H,4,9H2,(H,12,13)
InChIKeyRDVVWBMTOYQUTA-UHFFFAOYSA-N
XLogP-0.23
TPSA96.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 5-0.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(dihydroxymethyl)pyridine-3-carboxylic acid
CID 91298462
2-amino-2-(3-methyl-2-pyridinyl)ethanol
CID 55293811
2-(4-amino-1,2-dihydroxybutyl)pyridine-3-carboxylic acid
CID 171881352
2-(2-carboxy-1,2-dihydroxyethyl)pyridine-3-carboxylic acid
CID 170824061
(2R)-2-amino-2-(3-methoxy-2-pyridinyl)ethanol
CID 96850177
(2S)-2-amino-2-[3-(trifluoromethyl)-2-pyridinyl]ethanol
CID 131168070
2-(3-ethoxy-1,2-dihydroxy-3-oxopropyl)pyridine-3-carboxylic acid
CID 171866199
2-[1-(2-carbamoylhydrazinyl)ethyl]pyridine-3-carboxylic acid
CID 174445183
2-(2-cyano-1,2-dihydroxyethyl)pyridine-3-carboxylic acid
CID 171870325
2-[(2S)-1-hydroxybutan-2-yl]pyridine-3-carboxamide
CID 140609649
2-(2-aminopropoxy)pyridine-3-carboxylic acid
CID 117096540
2-(1-hydroxybutan-2-yl)pyridine-3-carboxamide;hydrochloride
CID 142680777

Frequently Asked Questions

What is the IUPAC name of 2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid?
The IUPAC name of 2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid (CID 55293543) is 2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid.
What is the SMILES notation for 2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid?
The canonical SMILES for 2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid is NC(CO)c1ncccc1C(=O)O.
What is the InChIKey of 2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid?
The InChIKey is RDVVWBMTOYQUTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3/c9-6(4-11)7-5(8(12)13)2-1-3-10-7/h1-3,6,11H,4,9H2,(H,12,13).
What are the key properties of 2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid?
2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid has a molecular weight of 182.18 g/mol, XLogP of -0.23, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-amino-2-hydroxyethyl)pyridine-3-carboxylic acid is sourced from PubChem (CID 55293543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).