1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide

C14H22N2O2 — CID 108970589

IUPAC1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide
SMILESO=C(NC1CCCCC1)C1(C(=O)NC2CC2)CC1
InChIInChI=1S/C14H22N2O2/c17-12(15-10-4-2-1-3-5-10)14(8-9-14)13(18)16-11-6-7-11/h10-11H,1-9H2,(H,15,17)(H,16,18)
InChIKeyTXSCFKWUUSIGTM-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.49
Rot. Bonds4

About 1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide

1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide (PubChem CID 108970589) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide.

Molecular Properties

Compound Name1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide
PubChem CID108970589
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide
SMILESO=C(NC1CCCCC1)C1(C(=O)NC2CC2)CC1
InChIInChI=1S/C14H22N2O2/c17-12(15-10-4-2-1-3-5-10)14(8-9-14)13(18)16-11-6-7-11/h10-11H,1-9H2,(H,15,17)(H,16,18)
InChIKeyTXSCFKWUUSIGTM-UHFFFAOYSA-N
XLogP1.49
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

N-cyclooctyl-1-(N'-hydroxycarbamimidoyl)cyclopropane-1-carboxamide
CID 80590605
1-N'-cycloheptyl-1-N-(2-methylpropyl)cyclopropane-1,1-dicarboxamide
CID 108971243
1-N-butyl-1-N'-cycloheptylcyclopropane-1,1-dicarboxamide
CID 108971049
1-N'-cyclohexyl-1-N-pentylcyclopropane-1,1-dicarboxamide
CID 108972201
1-N'-(4-acetamidophenyl)-1-N-cyclohexylcyclopropane-1,1-dicarboxamide
CID 108972267
N-cyclohexyl-1-methylcyclopropane-1-carboxamide
CID 130162659
1-N'-cycloheptyl-1-N-(2-phenylethyl)cyclopropane-1,1-dicarboxamide
CID 108977110
1-N'-(3-acetamidophenyl)-1-N-cyclohexylcyclopropane-1,1-dicarboxamide
CID 108972266
1-N'-cycloheptyl-1-N-(2-morpholin-4-ylethyl)cyclopropane-1,1-dicarboxamide
CID 108973625
N-cyclopentyl-1-(4-methylpiperazine-1-carbonyl)cyclopropane-1-carboxamide
CID 108971761
N-cyclopropyl-1-(N'-hydroxycarbamimidoyl)cyclopropane-1-carboxamide
CID 80590677
1-N'-(2-tert-butylphenyl)-1-N-cyclohexylcyclopropane-1,1-dicarboxamide
CID 108972233

Frequently Asked Questions

What is the IUPAC name of 1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide?
The IUPAC name of 1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide (CID 108970589) is 1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide.
What is the SMILES notation for 1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide?
The canonical SMILES for 1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide is O=C(NC1CCCCC1)C1(C(=O)NC2CC2)CC1.
What is the InChIKey of 1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide?
The InChIKey is TXSCFKWUUSIGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c17-12(15-10-4-2-1-3-5-10)14(8-9-14)13(18)16-11-6-7-11/h10-11H,1-9H2,(H,15,17)(H,16,18).
What are the key properties of 1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide?
1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide has a molecular weight of 250.34 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclohexyl-1-N'-cyclopropylcyclopropane-1,1-dicarboxamide is sourced from PubChem (CID 108970589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).