N-ethoxy-2-propylpentanamide

C10H21NO2 — CID 115532275

IUPACN-ethoxy-2-propylpentanamide
SMILESCCCC(CCC)C(=O)NOCC
InChIInChI=1S/C10H21NO2/c1-4-7-9(8-5-2)10(12)11-13-6-3/h9H,4-8H2,1-3H3,(H,11,12)
InChIKeyRYCLYLRUFCUPAR-UHFFFAOYSA-N
MW187.28 g/mol
LogP2.27
Rot. Bonds7

About N-ethoxy-2-propylpentanamide

N-ethoxy-2-propylpentanamide (PubChem CID 115532275) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is N-ethoxy-2-propylpentanamide.

Molecular Properties

Compound NameN-ethoxy-2-propylpentanamide
PubChem CID115532275
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC NameN-ethoxy-2-propylpentanamide
SMILESCCCC(CCC)C(=O)NOCC
InChIInChI=1S/C10H21NO2/c1-4-7-9(8-5-2)10(12)11-13-6-3/h9H,4-8H2,1-3H3,(H,11,12)
InChIKeyRYCLYLRUFCUPAR-UHFFFAOYSA-N
XLogP2.27
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-ethoxypentanamide
CID 64974803
(2S)-N-ethoxy-2-methylpentanamide
CID 90228672
diethyl 2-(2-propylpentanoylamino)propanedioate
CID 82989756
N-ethoxy-2-methylpropanamide
CID 60717901
ethyl 3-(2-propylpentanoylamino)propanoate
CID 23363631
ethene;ethyl 2-propylpentanoate
CID 160741230
2-propylpentanoyl 2-propylpentanoate
CID 10923624
2-propylhexanehydrazide
CID 86746660
(2S)-2-amino-N-ethoxy-3,3-dimethylbutanamide
CID 64974712
3-amino-4-(ethoxyamino)-4-oxobutanoic acid
CID 64974788
2-dodecyl-N-(2-dodecyltetradecanoylamino)oxytetradecanamide
CID 173246682
N-ethoxy-2-methylbut-3-enamide
CID 143446399

Frequently Asked Questions

What is the IUPAC name of N-ethoxy-2-propylpentanamide?
The IUPAC name of N-ethoxy-2-propylpentanamide (CID 115532275) is N-ethoxy-2-propylpentanamide.
What is the SMILES notation for N-ethoxy-2-propylpentanamide?
The canonical SMILES for N-ethoxy-2-propylpentanamide is CCCC(CCC)C(=O)NOCC.
What is the InChIKey of N-ethoxy-2-propylpentanamide?
The InChIKey is RYCLYLRUFCUPAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-4-7-9(8-5-2)10(12)11-13-6-3/h9H,4-8H2,1-3H3,(H,11,12).
What are the key properties of N-ethoxy-2-propylpentanamide?
N-ethoxy-2-propylpentanamide has a molecular weight of 187.28 g/mol, XLogP of 2.27, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-2-propylpentanamide is sourced from PubChem (CID 115532275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).