3-amino-N-(3-hydroxy-2-pyridinyl)propanamide

C8H11N3O2 — CID 110460198

IUPAC3-amino-N-(3-hydroxy-2-pyridinyl)propanamide
SMILESNCCC(=O)Nc1ncccc1O
InChIInChI=1S/C8H11N3O2/c9-4-3-7(13)11-8-6(12)2-1-5-10-8/h1-2,5,12H,3-4,9H2,(H,10,11,13)
InChIKeyLRPNRXLLJZUYKK-UHFFFAOYSA-N
MW181.20 g/mol
LogP0.07
Rot. Bonds3

About 3-amino-N-(3-hydroxy-2-pyridinyl)propanamide

3-amino-N-(3-hydroxy-2-pyridinyl)propanamide (PubChem CID 110460198) has the molecular formula C8H11N3O2 and a molecular weight of 181.20 g/mol. Its IUPAC name is 3-amino-N-(3-hydroxy-2-pyridinyl)propanamide.

Molecular Properties

Compound Name3-amino-N-(3-hydroxy-2-pyridinyl)propanamide
PubChem CID110460198
Molecular FormulaC8H11N3O2
Molecular Weight181.20 g/mol
Exact Mass181.09
IUPAC Name3-amino-N-(3-hydroxy-2-pyridinyl)propanamide
SMILESNCCC(=O)Nc1ncccc1O
InChIInChI=1S/C8H11N3O2/c9-4-3-7(13)11-8-6(12)2-1-5-10-8/h1-2,5,12H,3-4,9H2,(H,10,11,13)
InChIKeyLRPNRXLLJZUYKK-UHFFFAOYSA-N
XLogP0.07
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.20
LogP ≤ 50.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-hydroxy-2-pyridinyl)propanamide?
The IUPAC name of 3-amino-N-(3-hydroxy-2-pyridinyl)propanamide (CID 110460198) is 3-amino-N-(3-hydroxy-2-pyridinyl)propanamide.
What is the SMILES notation for 3-amino-N-(3-hydroxy-2-pyridinyl)propanamide?
The canonical SMILES for 3-amino-N-(3-hydroxy-2-pyridinyl)propanamide is NCCC(=O)Nc1ncccc1O.
What is the InChIKey of 3-amino-N-(3-hydroxy-2-pyridinyl)propanamide?
The InChIKey is LRPNRXLLJZUYKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c9-4-3-7(13)11-8-6(12)2-1-5-10-8/h1-2,5,12H,3-4,9H2,(H,10,11,13).
What are the key properties of 3-amino-N-(3-hydroxy-2-pyridinyl)propanamide?
3-amino-N-(3-hydroxy-2-pyridinyl)propanamide has a molecular weight of 181.20 g/mol, XLogP of 0.07, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-hydroxy-2-pyridinyl)propanamide is sourced from PubChem (CID 110460198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).