N-(2-cyclopropyl-2-hydroxyethyl)nonanamide

C14H27NO2 — CID 63294974

IUPACN-(2-cyclopropyl-2-hydroxyethyl)nonanamide
SMILESCCCCCCCCC(=O)NCC(O)C1CC1
InChIInChI=1S/C14H27NO2/c1-2-3-4-5-6-7-8-14(17)15-11-13(16)12-9-10-12/h12-13,16H,2-11H2,1H3,(H,15,17)
InChIKeyGBJHZBCUJULPAG-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.62
Rot. Bonds10

About N-(2-cyclopropyl-2-hydroxyethyl)nonanamide

N-(2-cyclopropyl-2-hydroxyethyl)nonanamide (PubChem CID 63294974) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-(2-cyclopropyl-2-hydroxyethyl)nonanamide.

Molecular Properties

Compound NameN-(2-cyclopropyl-2-hydroxyethyl)nonanamide
PubChem CID63294974
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-(2-cyclopropyl-2-hydroxyethyl)nonanamide
SMILESCCCCCCCCC(=O)NCC(O)C1CC1
InChIInChI=1S/C14H27NO2/c1-2-3-4-5-6-7-8-14(17)15-11-13(16)12-9-10-12/h12-13,16H,2-11H2,1H3,(H,15,17)
InChIKeyGBJHZBCUJULPAG-UHFFFAOYSA-N
XLogP2.62
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.62
H-Bond Donors ≤ 52
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-(2-cyclopropyl-2-hydroxyethyl)nonanamide?
The IUPAC name of N-(2-cyclopropyl-2-hydroxyethyl)nonanamide (CID 63294974) is N-(2-cyclopropyl-2-hydroxyethyl)nonanamide.
What is the SMILES notation for N-(2-cyclopropyl-2-hydroxyethyl)nonanamide?
The canonical SMILES for N-(2-cyclopropyl-2-hydroxyethyl)nonanamide is CCCCCCCCC(=O)NCC(O)C1CC1.
What is the InChIKey of N-(2-cyclopropyl-2-hydroxyethyl)nonanamide?
The InChIKey is GBJHZBCUJULPAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-2-3-4-5-6-7-8-14(17)15-11-13(16)12-9-10-12/h12-13,16H,2-11H2,1H3,(H,15,17).
What are the key properties of N-(2-cyclopropyl-2-hydroxyethyl)nonanamide?
N-(2-cyclopropyl-2-hydroxyethyl)nonanamide has a molecular weight of 241.37 g/mol, XLogP of 2.62, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-2-hydroxyethyl)nonanamide is sourced from PubChem (CID 63294974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).