2-hydroxypentanediamide

C5H10N2O3 — CID 559184

IUPAC2-hydroxypentanediamide
SMILESNC(=O)CCC(O)C(N)=O
InChIInChI=1S/C5H10N2O3/c6-4(9)2-1-3(8)5(7)10/h3,8H,1-2H2,(H2,6,9)(H2,7,10)
InChIKeyYXFZJXLQGULFAG-UHFFFAOYSA-N
MW146.15 g/mol
LogP-1.90
Rot. Bonds4

About 2-hydroxypentanediamide

2-hydroxypentanediamide (PubChem CID 559184) has the molecular formula C5H10N2O3 and a molecular weight of 146.15 g/mol. Its IUPAC name is 2-hydroxypentanediamide.

Molecular Properties

Compound Name2-hydroxypentanediamide
PubChem CID559184
Molecular FormulaC5H10N2O3
Molecular Weight146.15 g/mol
Exact Mass146.07
IUPAC Name2-hydroxypentanediamide
SMILESNC(=O)CCC(O)C(N)=O
InChIInChI=1S/C5H10N2O3/c6-4(9)2-1-3(8)5(7)10/h3,8H,1-2H2,(H2,6,9)(H2,7,10)
InChIKeyYXFZJXLQGULFAG-UHFFFAOYSA-N
XLogP-1.90
TPSA106.41 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 5-1.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-hydroxy-4-iodobutanamide
CID 143841991
(4R)-4,5-dihydroxypentanamide
CID 140573063
2-methylpentanediamide
CID 19688970
(2R)-2-methylpentanediamide
CID 90202517
2-(2-hydroxypropyl)pentanediamide
CID 23104492
2-(2-hydroxyethyl)pentanediamide
CID 23104502
(2S)-2-ethylpentanediamide
CID 146526357
5-amino-2-(3-amino-3-oxopropyl)-5-oxopentanoic acid
CID 100986466
2,5,5,6,6-pentahydroxyhexanamide
CID 145336879
2-hydroxyoctadecanamide
CID 14598043
2-hydroxy-6-oxohexanamide
CID 175466908
2,5-bis(15N)(azanyl)-5-oxopentanoic acid
CID 87103617

Frequently Asked Questions

What is the IUPAC name of 2-hydroxypentanediamide?
The IUPAC name of 2-hydroxypentanediamide (CID 559184) is 2-hydroxypentanediamide.
What is the SMILES notation for 2-hydroxypentanediamide?
The canonical SMILES for 2-hydroxypentanediamide is NC(=O)CCC(O)C(N)=O.
What is the InChIKey of 2-hydroxypentanediamide?
The InChIKey is YXFZJXLQGULFAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O3/c6-4(9)2-1-3(8)5(7)10/h3,8H,1-2H2,(H2,6,9)(H2,7,10).
What are the key properties of 2-hydroxypentanediamide?
2-hydroxypentanediamide has a molecular weight of 146.15 g/mol, XLogP of -1.90, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxypentanediamide is sourced from PubChem (CID 559184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).