1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide

C18H24N2O2 — CID 108971848

IUPAC1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide
SMILESCCN(C(=O)C1(C(=O)NC2CCCC2)CC1)c1ccccc1
InChIInChI=1S/C18H24N2O2/c1-2-20(15-10-4-3-5-11-15)17(22)18(12-13-18)16(21)19-14-8-6-7-9-14/h3-5,10-11,14H,2,6-9,12-13H2,1H3,(H,19,21)
InChIKeyVKPYNJAQZXZMCG-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.88
Rot. Bonds5

About 1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide

1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide (PubChem CID 108971848) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide.

Molecular Properties

Compound Name1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide
PubChem CID108971848
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide
SMILESCCN(C(=O)C1(C(=O)NC2CCCC2)CC1)c1ccccc1
InChIInChI=1S/C18H24N2O2/c1-2-20(15-10-4-3-5-11-15)17(22)18(12-13-18)16(21)19-14-8-6-7-9-14/h3-5,10-11,14H,2,6-9,12-13H2,1H3,(H,19,21)
InChIKeyVKPYNJAQZXZMCG-UHFFFAOYSA-N
XLogP2.88
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-N-(1,1-dioxothiolan-3-yl)-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide
CID 108977960
3-cyclohexyl-1-ethyl-1-phenylurea
CID 17371090
1-N'-benzyl-1-N-cyclohexyl-1-N'-propan-2-ylcyclopropane-1,1-dicarboxamide
CID 108972199
1-N'-ethyl-1-N'-phenyl-1-N-(3-phenylpropyl)cyclopropane-1,1-dicarboxamide
CID 108979188
1-N'-ethyl-1-N'-phenyl-1-N-(4-propan-2-ylphenyl)cyclopropane-1,1-dicarboxamide
CID 108981840
1-N-(4-chloro-2-methylphenyl)-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide
CID 108981853
1-N-cyclohexyl-3-N-ethyl-3-N-phenylbenzene-1,3-dicarboxamide
CID 109052208
2-(N-acetylanilino)-N-cyclopentylacetamide
CID 113167073
1-N'-cycloheptyl-1-N-(2-phenylethyl)cyclopropane-1,1-dicarboxamide
CID 108977110
N-ethyl-N,1-diphenylcyclobutane-1-carboxamide
CID 69093061
N-ethyl-1-(4-methylpiperazine-1-carbonyl)-N-phenylcyclopropane-1-carboxamide
CID 108973986
N-ethyl-N-phenylcyclohexanecarboxamide
CID 3884538

Frequently Asked Questions

What is the IUPAC name of 1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide?
The IUPAC name of 1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide (CID 108971848) is 1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide.
What is the SMILES notation for 1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide?
The canonical SMILES for 1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide is CCN(C(=O)C1(C(=O)NC2CCCC2)CC1)c1ccccc1.
What is the InChIKey of 1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide?
The InChIKey is VKPYNJAQZXZMCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-2-20(15-10-4-3-5-11-15)17(22)18(12-13-18)16(21)19-14-8-6-7-9-14/h3-5,10-11,14H,2,6-9,12-13H2,1H3,(H,19,21).
What are the key properties of 1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide?
1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide has a molecular weight of 300.40 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide is sourced from PubChem (CID 108971848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).