N-nonan-5-yloxypropanamide

C12H25NO2 — CID 140841027

IUPACN-nonan-5-yloxypropanamide
SMILESCCCCC(CCCC)ONC(=O)CC
InChIInChI=1S/C12H25NO2/c1-4-7-9-11(10-8-5-2)15-13-12(14)6-3/h11H,4-10H2,1-3H3,(H,13,14)
InChIKeyOMBIUFFAEPGSIE-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.19
Rot. Bonds9

About N-nonan-5-yloxypropanamide

N-nonan-5-yloxypropanamide (PubChem CID 140841027) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is N-nonan-5-yloxypropanamide.

Molecular Properties

Compound NameN-nonan-5-yloxypropanamide
PubChem CID140841027
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC NameN-nonan-5-yloxypropanamide
SMILESCCCCC(CCCC)ONC(=O)CC
InChIInChI=1S/C12H25NO2/c1-4-7-9-11(10-8-5-2)15-13-12(14)6-3/h11H,4-10H2,1-3H3,(H,13,14)
InChIKeyOMBIUFFAEPGSIE-UHFFFAOYSA-N
XLogP3.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.19
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

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CID 86250289
heptan-3-yl 2-methylidenebutanoate
CID 156770774
N-(3-ethyloctan-3-yloxy)propanamide
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3-amino-N-hexan-2-yl-3-methylbutanamide
CID 64677229
diheptan-3-yl carbonate
CID 87131933
methyl (2S)-2-aminohexanoate
CID 7018840
(2S)-2-(3-aminopropanoylamino)hexanoic acid
CID 22212413
3-hydroxy-4-octan-4-yloxy-4-oxobutanoic acid
CID 87216628
N-hexan-2-yl-2-methoxyacetamide
CID 64592486
N-[(2R)-hexan-2-yl]-2-methoxyacetamide
CID 24773041
acetic acid;4-octan-4-yloxyoctane
CID 175036803
N-dodecan-2-ylpropanamide
CID 174988669

Frequently Asked Questions

What is the IUPAC name of N-nonan-5-yloxypropanamide?
The IUPAC name of N-nonan-5-yloxypropanamide (CID 140841027) is N-nonan-5-yloxypropanamide.
What is the SMILES notation for N-nonan-5-yloxypropanamide?
The canonical SMILES for N-nonan-5-yloxypropanamide is CCCCC(CCCC)ONC(=O)CC.
What is the InChIKey of N-nonan-5-yloxypropanamide?
The InChIKey is OMBIUFFAEPGSIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-4-7-9-11(10-8-5-2)15-13-12(14)6-3/h11H,4-10H2,1-3H3,(H,13,14).
What are the key properties of N-nonan-5-yloxypropanamide?
N-nonan-5-yloxypropanamide has a molecular weight of 215.34 g/mol, XLogP of 3.19, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-nonan-5-yloxypropanamide is sourced from PubChem (CID 140841027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).