4-hydroxy-N-(thiolan-3-yl)pentanamide

C9H17NO2S — CID 103064924

IUPAC4-hydroxy-N-(thiolan-3-yl)pentanamide
SMILESCC(O)CCC(=O)NC1CCSC1
InChIInChI=1S/C9H17NO2S/c1-7(11)2-3-9(12)10-8-4-5-13-6-8/h7-8,11H,2-6H2,1H3,(H,10,12)
InChIKeyVQMYPBMOYGDSNC-UHFFFAOYSA-N
MW203.31 g/mol
LogP0.77
Rot. Bonds4

About 4-hydroxy-N-(thiolan-3-yl)pentanamide

4-hydroxy-N-(thiolan-3-yl)pentanamide (PubChem CID 103064924) has the molecular formula C9H17NO2S and a molecular weight of 203.31 g/mol. Its IUPAC name is 4-hydroxy-N-(thiolan-3-yl)pentanamide.

Molecular Properties

Compound Name4-hydroxy-N-(thiolan-3-yl)pentanamide
PubChem CID103064924
Molecular FormulaC9H17NO2S
Molecular Weight203.31 g/mol
Exact Mass203.10
IUPAC Name4-hydroxy-N-(thiolan-3-yl)pentanamide
SMILESCC(O)CCC(=O)NC1CCSC1
InChIInChI=1S/C9H17NO2S/c1-7(11)2-3-9(12)10-8-4-5-13-6-8/h7-8,11H,2-6H2,1H3,(H,10,12)
InChIKeyVQMYPBMOYGDSNC-UHFFFAOYSA-N
XLogP0.77
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.31
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(thiolan-3-yl)butanamide
CID 103811759
4-(2-aminoethyl)-N-(thiolan-3-yl)heptanamide
CID 103063122
1-(2-hydroxypropyl)-3-(thiolan-3-yl)urea
CID 117234419
4-hydroxy-N-(oxan-4-yl)pentanamide
CID 79191727
6-amino-4,4-dimethyl-N-(thiolan-3-yl)hexanamide
CID 103063106
2-cyclopropyl-N-(thiolan-3-yl)propanamide
CID 127000268
4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)pentanamide
CID 79200680
(2S)-2-amino-3-methyl-N-[2-oxo-2-(thiolan-3-ylamino)ethyl]butanamide
CID 113345692
(2S)-1-[[(3S)-thiolan-3-yl]amino]propan-2-ol
CID 93033310
propan-2-yl N-(thiolan-3-yl)carbamate
CID 103062730
3-amino-3-sulfanylidene-N-(thiolan-3-yl)propanamide
CID 103063158
2-fluoro-3-methyl-N-(thiolan-3-yl)butanamide
CID 130694647

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(thiolan-3-yl)pentanamide?
The IUPAC name of 4-hydroxy-N-(thiolan-3-yl)pentanamide (CID 103064924) is 4-hydroxy-N-(thiolan-3-yl)pentanamide.
What is the SMILES notation for 4-hydroxy-N-(thiolan-3-yl)pentanamide?
The canonical SMILES for 4-hydroxy-N-(thiolan-3-yl)pentanamide is CC(O)CCC(=O)NC1CCSC1.
What is the InChIKey of 4-hydroxy-N-(thiolan-3-yl)pentanamide?
The InChIKey is VQMYPBMOYGDSNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2S/c1-7(11)2-3-9(12)10-8-4-5-13-6-8/h7-8,11H,2-6H2,1H3,(H,10,12).
What are the key properties of 4-hydroxy-N-(thiolan-3-yl)pentanamide?
4-hydroxy-N-(thiolan-3-yl)pentanamide has a molecular weight of 203.31 g/mol, XLogP of 0.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(thiolan-3-yl)pentanamide is sourced from PubChem (CID 103064924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).