2-cyanononanamide

C10H18N2O — CID 91478546

IUPAC2-cyanononanamide
SMILESCCCCCCCC(C#N)C(N)=O
InChIInChI=1S/C10H18N2O/c1-2-3-4-5-6-7-9(8-11)10(12)13/h9H,2-7H2,1H3,(H2,12,13)
InChIKeyIWWUESBQXOUUGG-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.97
Rot. Bonds7

About 2-cyanononanamide

2-cyanononanamide (PubChem CID 91478546) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-cyanononanamide.

Molecular Properties

Compound Name2-cyanononanamide
PubChem CID91478546
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name2-cyanononanamide
SMILESCCCCCCCC(C#N)C(N)=O
InChIInChI=1S/C10H18N2O/c1-2-3-4-5-6-7-9(8-11)10(12)13/h9H,2-7H2,1H3,(H2,12,13)
InChIKeyIWWUESBQXOUUGG-UHFFFAOYSA-N
XLogP1.97
TPSA66.88 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.97
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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Related Compounds

2-cyanononadecanoic acid
CID 87316687
2-cyanoheptadecanoic acid
CID 87316675
2-cyanohenicosanethioic S-acid
CID 123529420
azane;2-cyanoundecanoic acid
CID 174447184
prop-2-enyl 2-cyanodecanoate
CID 14468567
4-cyanoundecanamide
CID 71433018
butyl 2-cyano-14-hydroxytetradecanoate
CID 45139506
2-hexyloctanamide
CID 87302701
2-octyldecanamide
CID 19104479
2-dodecylnonadecanamide
CID 175503182
2-hydroxyoctadecanamide
CID 14598043
2-butyltetradecanamide
CID 57191211

Frequently Asked Questions

What is the IUPAC name of 2-cyanononanamide?
The IUPAC name of 2-cyanononanamide (CID 91478546) is 2-cyanononanamide.
What is the SMILES notation for 2-cyanononanamide?
The canonical SMILES for 2-cyanononanamide is CCCCCCCC(C#N)C(N)=O.
What is the InChIKey of 2-cyanononanamide?
The InChIKey is IWWUESBQXOUUGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-2-3-4-5-6-7-9(8-11)10(12)13/h9H,2-7H2,1H3,(H2,12,13).
What are the key properties of 2-cyanononanamide?
2-cyanononanamide has a molecular weight of 182.27 g/mol, XLogP of 1.97, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyanononanamide is sourced from PubChem (CID 91478546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).