N-ethyl-5-hydroxy-N-propan-2-ylpentanamide

C10H21NO2 — CID 79199528

IUPACN-ethyl-5-hydroxy-N-propan-2-ylpentanamide
SMILESCCN(C(=O)CCCCO)C(C)C
InChIInChI=1S/C10H21NO2/c1-4-11(9(2)3)10(13)7-5-6-8-12/h9,12H,4-8H2,1-3H3
InChIKeyWVPUEIFORTXCEF-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.41
Rot. Bonds6

About N-ethyl-5-hydroxy-N-propan-2-ylpentanamide

N-ethyl-5-hydroxy-N-propan-2-ylpentanamide (PubChem CID 79199528) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is N-ethyl-5-hydroxy-N-propan-2-ylpentanamide.

Molecular Properties

Compound NameN-ethyl-5-hydroxy-N-propan-2-ylpentanamide
PubChem CID79199528
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC NameN-ethyl-5-hydroxy-N-propan-2-ylpentanamide
SMILESCCN(C(=O)CCCCO)C(C)C
InChIInChI=1S/C10H21NO2/c1-4-11(9(2)3)10(13)7-5-6-8-12/h9,12H,4-8H2,1-3H3
InChIKeyWVPUEIFORTXCEF-UHFFFAOYSA-N
XLogP1.41
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-hydroxy-N-propan-2-ylpentanamide?
The IUPAC name of N-ethyl-5-hydroxy-N-propan-2-ylpentanamide (CID 79199528) is N-ethyl-5-hydroxy-N-propan-2-ylpentanamide.
What is the SMILES notation for N-ethyl-5-hydroxy-N-propan-2-ylpentanamide?
The canonical SMILES for N-ethyl-5-hydroxy-N-propan-2-ylpentanamide is CCN(C(=O)CCCCO)C(C)C.
What is the InChIKey of N-ethyl-5-hydroxy-N-propan-2-ylpentanamide?
The InChIKey is WVPUEIFORTXCEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-4-11(9(2)3)10(13)7-5-6-8-12/h9,12H,4-8H2,1-3H3.
What are the key properties of N-ethyl-5-hydroxy-N-propan-2-ylpentanamide?
N-ethyl-5-hydroxy-N-propan-2-ylpentanamide has a molecular weight of 187.28 g/mol, XLogP of 1.41, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-hydroxy-N-propan-2-ylpentanamide is sourced from PubChem (CID 79199528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).