N-(4-hydroxyoxolan-3-yl)propanamide

C7H13NO3 — CID 130659329

IUPACN-(4-hydroxyoxolan-3-yl)propanamide
SMILESCCC(=O)NC1COCC1O
InChIInChI=1S/C7H13NO3/c1-2-7(10)8-5-3-11-4-6(5)9/h5-6,9H,2-4H2,1H3,(H,8,10)
InChIKeyBVXGIUFQJCCMCT-UHFFFAOYSA-N
MW159.18 g/mol
LogP-0.73
Rot. Bonds2

About N-(4-hydroxyoxolan-3-yl)propanamide

N-(4-hydroxyoxolan-3-yl)propanamide (PubChem CID 130659329) has the molecular formula C7H13NO3 and a molecular weight of 159.18 g/mol. Its IUPAC name is N-(4-hydroxyoxolan-3-yl)propanamide.

Molecular Properties

Compound NameN-(4-hydroxyoxolan-3-yl)propanamide
PubChem CID130659329
Molecular FormulaC7H13NO3
Molecular Weight159.18 g/mol
Exact Mass159.09
IUPAC NameN-(4-hydroxyoxolan-3-yl)propanamide
SMILESCCC(=O)NC1COCC1O
InChIInChI=1S/C7H13NO3/c1-2-7(10)8-5-3-11-4-6(5)9/h5-6,9H,2-4H2,1H3,(H,8,10)
InChIKeyBVXGIUFQJCCMCT-UHFFFAOYSA-N
XLogP-0.73
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.18
LogP ≤ 5-0.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyoxolan-3-yl)propanamide?
The IUPAC name of N-(4-hydroxyoxolan-3-yl)propanamide (CID 130659329) is N-(4-hydroxyoxolan-3-yl)propanamide.
What is the SMILES notation for N-(4-hydroxyoxolan-3-yl)propanamide?
The canonical SMILES for N-(4-hydroxyoxolan-3-yl)propanamide is CCC(=O)NC1COCC1O.
What is the InChIKey of N-(4-hydroxyoxolan-3-yl)propanamide?
The InChIKey is BVXGIUFQJCCMCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO3/c1-2-7(10)8-5-3-11-4-6(5)9/h5-6,9H,2-4H2,1H3,(H,8,10).
What are the key properties of N-(4-hydroxyoxolan-3-yl)propanamide?
N-(4-hydroxyoxolan-3-yl)propanamide has a molecular weight of 159.18 g/mol, XLogP of -0.73, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyoxolan-3-yl)propanamide is sourced from PubChem (CID 130659329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).