N-[(1S,2S)-2-hydroxycyclopropyl]propanamide

C6H11NO2 — CID 139425542

IUPACN-[(1S,2S)-2-hydroxycyclopropyl]propanamide
SMILESCCC(=O)N[C@H]1C[C@@H]1O
InChIInChI=1S/C6H11NO2/c1-2-6(9)7-4-3-5(4)8/h4-5,8H,2-3H2,1H3,(H,7,9)/t4-,5-/m0/s1
InChIKeyNWIWGJVEQIYJAS-WHFBIAKZSA-N
MW129.16 g/mol
LogP-0.35
Rot. Bonds2

About N-[(1S,2S)-2-hydroxycyclopropyl]propanamide

N-[(1S,2S)-2-hydroxycyclopropyl]propanamide (PubChem CID 139425542) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is N-[(1S,2S)-2-hydroxycyclopropyl]propanamide.

Molecular Properties

Compound NameN-[(1S,2S)-2-hydroxycyclopropyl]propanamide
PubChem CID139425542
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC NameN-[(1S,2S)-2-hydroxycyclopropyl]propanamide
SMILESCCC(=O)N[C@H]1C[C@@H]1O
InChIInChI=1S/C6H11NO2/c1-2-6(9)7-4-3-5(4)8/h4-5,8H,2-3H2,1H3,(H,7,9)/t4-,5-/m0/s1
InChIKeyNWIWGJVEQIYJAS-WHFBIAKZSA-N
XLogP-0.35
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(1S,2S)-2-hydroxycyclopropyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2S)-2-hydroxycyclopropyl]propanamide?
The IUPAC name of N-[(1S,2S)-2-hydroxycyclopropyl]propanamide (CID 139425542) is N-[(1S,2S)-2-hydroxycyclopropyl]propanamide.
What is the SMILES notation for N-[(1S,2S)-2-hydroxycyclopropyl]propanamide?
The canonical SMILES for N-[(1S,2S)-2-hydroxycyclopropyl]propanamide is CCC(=O)N[C@H]1C[C@@H]1O.
What is the InChIKey of N-[(1S,2S)-2-hydroxycyclopropyl]propanamide?
The InChIKey is NWIWGJVEQIYJAS-WHFBIAKZSA-N. The full InChI is InChI=1S/C6H11NO2/c1-2-6(9)7-4-3-5(4)8/h4-5,8H,2-3H2,1H3,(H,7,9)/t4-,5-/m0/s1.
What are the key properties of N-[(1S,2S)-2-hydroxycyclopropyl]propanamide?
N-[(1S,2S)-2-hydroxycyclopropyl]propanamide has a molecular weight of 129.16 g/mol, XLogP of -0.35, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2S)-2-hydroxycyclopropyl]propanamide is sourced from PubChem (CID 139425542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).