N-(5-hydroxy-3-methylidenepentyl)acetamide

C8H15NO2 — CID 163373720

IUPACN-(5-hydroxy-3-methylidenepentyl)acetamide
SMILESC=C(CCO)CCNC(C)=O
InChIInChI=1S/C8H15NO2/c1-7(4-6-10)3-5-9-8(2)11/h10H,1,3-6H2,2H3,(H,9,11)
InChIKeyKGPRCZBRPPNOPR-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.45
Rot. Bonds5

About N-(5-hydroxy-3-methylidenepentyl)acetamide

N-(5-hydroxy-3-methylidenepentyl)acetamide (PubChem CID 163373720) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-(5-hydroxy-3-methylidenepentyl)acetamide.

Molecular Properties

Compound NameN-(5-hydroxy-3-methylidenepentyl)acetamide
PubChem CID163373720
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-(5-hydroxy-3-methylidenepentyl)acetamide
SMILESC=C(CCO)CCNC(C)=O
InChIInChI=1S/C8H15NO2/c1-7(4-6-10)3-5-9-8(2)11/h10H,1,3-6H2,2H3,(H,9,11)
InChIKeyKGPRCZBRPPNOPR-UHFFFAOYSA-N
XLogP0.45
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxy-3-methylidenepentyl)acetamide?
The IUPAC name of N-(5-hydroxy-3-methylidenepentyl)acetamide (CID 163373720) is N-(5-hydroxy-3-methylidenepentyl)acetamide.
What is the SMILES notation for N-(5-hydroxy-3-methylidenepentyl)acetamide?
The canonical SMILES for N-(5-hydroxy-3-methylidenepentyl)acetamide is C=C(CCO)CCNC(C)=O.
What is the InChIKey of N-(5-hydroxy-3-methylidenepentyl)acetamide?
The InChIKey is KGPRCZBRPPNOPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-7(4-6-10)3-5-9-8(2)11/h10H,1,3-6H2,2H3,(H,9,11).
What are the key properties of N-(5-hydroxy-3-methylidenepentyl)acetamide?
N-(5-hydroxy-3-methylidenepentyl)acetamide has a molecular weight of 157.21 g/mol, XLogP of 0.45, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxy-3-methylidenepentyl)acetamide is sourced from PubChem (CID 163373720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).