4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide

C10H21NO4 — CID 106248553

IUPAC4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide
SMILESCOCC(O)CCNC(=O)CCC(C)O
InChIInChI=1S/C10H21NO4/c1-8(12)3-4-10(14)11-6-5-9(13)7-15-2/h8-9,12-13H,3-7H2,1-2H3,(H,11,14)
InChIKeyPIIOMITVJIKVBJ-UHFFFAOYSA-N
MW219.28 g/mol
LogP-0.34
Rot. Bonds8

About 4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide

4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide (PubChem CID 106248553) has the molecular formula C10H21NO4 and a molecular weight of 219.28 g/mol. Its IUPAC name is 4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide.

Molecular Properties

Compound Name4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide
PubChem CID106248553
Molecular FormulaC10H21NO4
Molecular Weight219.28 g/mol
Exact Mass219.15
IUPAC Name4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide
SMILESCOCC(O)CCNC(=O)CCC(C)O
InChIInChI=1S/C10H21NO4/c1-8(12)3-4-10(14)11-6-5-9(13)7-15-2/h8-9,12-13H,3-7H2,1-2H3,(H,11,14)
InChIKeyPIIOMITVJIKVBJ-UHFFFAOYSA-N
XLogP-0.34
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 5-0.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-hydroxy-4-methoxybutyl)pentanamide
CID 103877026
N-(3-hydroxy-4-methoxybutyl)octanamide
CID 103877091
N-(3-hydroxy-4-methoxybutyl)dodecanamide
CID 103876970
4-(2-aminoethyl)-N-(3-hydroxy-4-methoxybutyl)-5,5-dimethylhexanamide
CID 106247393
4-hydroxy-N-(3-methylbutyl)pentanamide
CID 79001671
N-ethyl-3-[(3-hydroxy-4-methoxybutyl)amino]propanamide
CID 106246679
N-(3-hydroxy-4-methoxybutyl)-3-phenoxypropanamide
CID 103876749
4-amino-N-(3-hydroxy-4-methoxybutyl)-3-methoxybutanamide
CID 106247351
3-(2,6-dimethylphenoxy)-N-(3-hydroxy-4-methoxybutyl)propanamide
CID 103877668
N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide
CID 106247359
3-(4-aminophenyl)-N-(3-hydroxy-4-methoxybutyl)propanamide
CID 106242200
N-(3-hydroxy-4-methoxybutyl)-3-(4-methylphenoxy)propanamide
CID 103877644

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide?
The IUPAC name of 4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide (CID 106248553) is 4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide.
What is the SMILES notation for 4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide?
The canonical SMILES for 4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide is COCC(O)CCNC(=O)CCC(C)O.
What is the InChIKey of 4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide?
The InChIKey is PIIOMITVJIKVBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO4/c1-8(12)3-4-10(14)11-6-5-9(13)7-15-2/h8-9,12-13H,3-7H2,1-2H3,(H,11,14).
What are the key properties of 4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide?
4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide has a molecular weight of 219.28 g/mol, XLogP of -0.34, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide is sourced from PubChem (CID 106248553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).