acetaldehyde;N-cyclohexylcyclopropanecarboxamide

C12H21NO2 — CID 143959717

IUPACacetaldehyde;N-cyclohexylcyclopropanecarboxamide
SMILESCC=O.O=C(NC1CCCCC1)C1CC1
InChIInChI=1S/C10H17NO.C2H4O/c12-10(8-6-7-8)11-9-4-2-1-3-5-9;1-2-3/h8-9H,1-7H2,(H,11,12);2H,1H3
InChIKeyUOYYCBGYRKCFGA-UHFFFAOYSA-N
MW211.30 g/mol
LogP2.05
Rot. Bonds2

About acetaldehyde;N-cyclohexylcyclopropanecarboxamide

acetaldehyde;N-cyclohexylcyclopropanecarboxamide (PubChem CID 143959717) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is acetaldehyde;N-cyclohexylcyclopropanecarboxamide.

Molecular Properties

Compound Nameacetaldehyde;N-cyclohexylcyclopropanecarboxamide
PubChem CID143959717
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC Nameacetaldehyde;N-cyclohexylcyclopropanecarboxamide
SMILESCC=O.O=C(NC1CCCCC1)C1CC1
InChIInChI=1S/C10H17NO.C2H4O/c12-10(8-6-7-8)11-9-4-2-1-3-5-9;1-2-3/h8-9H,1-7H2,(H,11,12);2H,1H3
InChIKeyUOYYCBGYRKCFGA-UHFFFAOYSA-N
XLogP2.05
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide
CID 2982201
N-cycloheptylcycloheptanecarboxamide
CID 129091005
N-cyclodecylcyclododecanecarboxamide
CID 135182352
N-cyclopentylcyclobutanecarboxamide
CID 21158774
N-cyclopropylcycloheptanecarboxamide
CID 62778853
N-cyclopropylcyclohexanecarboxamide
CID 3412875
N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide
CID 166761294
4-(cyclobutylcarbamoyl)cyclohexane-1-carboxylic acid
CID 63784542
N-cycloheptylpiperidine-4-carboxamide;hydrochloride
CID 70702347
3-(cyclooctylcarbamoyl)cyclopentane-1-carboxylic acid
CID 103549818
N-cyclohexyl-4-(4-formylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
CID 109146089
5-[(1R)-1-aminoethyl]-N-cyclodecylcyclooctane-1-carboxamide
CID 126513454

Frequently Asked Questions

What is the IUPAC name of acetaldehyde;N-cyclohexylcyclopropanecarboxamide?
The IUPAC name of acetaldehyde;N-cyclohexylcyclopropanecarboxamide (CID 143959717) is acetaldehyde;N-cyclohexylcyclopropanecarboxamide.
What is the SMILES notation for acetaldehyde;N-cyclohexylcyclopropanecarboxamide?
The canonical SMILES for acetaldehyde;N-cyclohexylcyclopropanecarboxamide is CC=O.O=C(NC1CCCCC1)C1CC1.
What is the InChIKey of acetaldehyde;N-cyclohexylcyclopropanecarboxamide?
The InChIKey is UOYYCBGYRKCFGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO.C2H4O/c12-10(8-6-7-8)11-9-4-2-1-3-5-9;1-2-3/h8-9H,1-7H2,(H,11,12);2H,1H3.
What are the key properties of acetaldehyde;N-cyclohexylcyclopropanecarboxamide?
acetaldehyde;N-cyclohexylcyclopropanecarboxamide has a molecular weight of 211.30 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for acetaldehyde;N-cyclohexylcyclopropanecarboxamide is sourced from PubChem (CID 143959717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).