2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide

C11H17N3O2 — CID 115180171

IUPAC2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide
SMILESCN(CCc1ccccn1)C(=O)C(N)CO
InChIInChI=1S/C11H17N3O2/c1-14(11(16)10(12)8-15)7-5-9-4-2-3-6-13-9/h2-4,6,10,15H,5,7-8,12H2,1H3
InChIKeyWONSRKRXVRALOF-UHFFFAOYSA-N
MW223.28 g/mol
LogP-0.60
Rot. Bonds5

About 2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide

2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide (PubChem CID 115180171) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide.

Molecular Properties

Compound Name2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide
PubChem CID115180171
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide
SMILESCN(CCc1ccccn1)C(=O)C(N)CO
InChIInChI=1S/C11H17N3O2/c1-14(11(16)10(12)8-15)7-5-9-4-2-3-6-13-9/h2-4,6,10,15H,5,7-8,12H2,1H3
InChIKeyWONSRKRXVRALOF-UHFFFAOYSA-N
XLogP-0.60
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide?
The IUPAC name of 2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide (CID 115180171) is 2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide.
What is the SMILES notation for 2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide?
The canonical SMILES for 2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide is CN(CCc1ccccn1)C(=O)C(N)CO.
What is the InChIKey of 2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide?
The InChIKey is WONSRKRXVRALOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-14(11(16)10(12)8-15)7-5-9-4-2-3-6-13-9/h2-4,6,10,15H,5,7-8,12H2,1H3.
What are the key properties of 2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide?
2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide has a molecular weight of 223.28 g/mol, XLogP of -0.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide is sourced from PubChem (CID 115180171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).