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

C7H16N2O3 — CID 59892302

IUPAC3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide
SMILESCOCC(O)CNC(=O)CCN
InChIInChI=1S/C7H16N2O3/c1-12-5-6(10)4-9-7(11)2-3-8/h6,10H,2-5,8H2,1H3,(H,9,11)
InChIKeyHQQLUSROWVZHDZ-UHFFFAOYSA-N
MW176.22 g/mol
LogP-1.54
Rot. Bonds6

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

3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide (PubChem CID 59892302) has the molecular formula C7H16N2O3 and a molecular weight of 176.22 g/mol. Its IUPAC name is 3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide.

Molecular Properties

Compound Name3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide
PubChem CID59892302
Molecular FormulaC7H16N2O3
Molecular Weight176.22 g/mol
Exact Mass176.12
IUPAC Name3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide
SMILESCOCC(O)CNC(=O)CCN
InChIInChI=1S/C7H16N2O3/c1-12-5-6(10)4-9-7(11)2-3-8/h6,10H,2-5,8H2,1H3,(H,9,11)
InChIKeyHQQLUSROWVZHDZ-UHFFFAOYSA-N
XLogP-1.54
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 5-1.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide?
The IUPAC name of 3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide (CID 59892302) is 3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide.
What is the SMILES notation for 3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide?
The canonical SMILES for 3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide is COCC(O)CNC(=O)CCN.
What is the InChIKey of 3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide?
The InChIKey is HQQLUSROWVZHDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O3/c1-12-5-6(10)4-9-7(11)2-3-8/h6,10H,2-5,8H2,1H3,(H,9,11).
What are the key properties of 3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide?
3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide has a molecular weight of 176.22 g/mol, XLogP of -1.54, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide is sourced from PubChem (CID 59892302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).