1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide

C17H24N2O3 — CID 109139628

IUPAC1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
SMILESCCOc1ccccc1NC(=O)C1CC1C(=O)NC(C)(C)C
InChIInChI=1S/C17H24N2O3/c1-5-22-14-9-7-6-8-13(14)18-15(20)11-10-12(11)16(21)19-17(2,3)4/h6-9,11-12H,5,10H2,1-4H3,(H,18,20)(H,19,21)
InChIKeyZJWNBXPRSPZSTB-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.57
Rot. Bonds5

About 1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide

1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide (PubChem CID 109139628) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
PubChem CID109139628
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
SMILESCCOc1ccccc1NC(=O)C1CC1C(=O)NC(C)(C)C
InChIInChI=1S/C17H24N2O3/c1-5-22-14-9-7-6-8-13(14)18-15(20)11-10-12(11)16(21)19-17(2,3)4/h6-9,11-12H,5,10H2,1-4H3,(H,18,20)(H,19,21)
InChIKeyZJWNBXPRSPZSTB-UHFFFAOYSA-N
XLogP2.57
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-cyclopentyl-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109132110
1-N-(2,6-difluorophenyl)-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143509
1-N-(2-ethoxyphenyl)-2-N-(3-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141044
1-N-(2-ethoxyphenyl)-2-N-[(4-fluorophenyl)methyl]cyclopropane-1,2-dicarboxamide
CID 109136109
2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143497
2-N-(3-chlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109142878
4-N-(2-ethoxyphenyl)-1-N-(2-methoxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109151014
2-amino-N-(2-ethoxyphenyl)cyclohexane-1-carboxamide
CID 64817550
1-N-tert-butyl-2-N-phenylcyclopropane-1,2-dicarboxamide
CID 109139586
N-(2-ethoxyphenyl)-1,1-dioxothiane-4-carboxamide
CID 110860155
N-(2-ethoxyphenyl)-9-oxobicyclo[3.3.1]nonane-3-carboxamide
CID 2969703
cis-(1S,2R)-N-(2-ethoxyphenyl)-2-methyl-4-oxocyclohexane-1-carboxamide
CID 97248669

Frequently Asked Questions

What is the IUPAC name of 1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide?
The IUPAC name of 1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide (CID 109139628) is 1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide is CCOc1ccccc1NC(=O)C1CC1C(=O)NC(C)(C)C.
What is the InChIKey of 1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide?
The InChIKey is ZJWNBXPRSPZSTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-5-22-14-9-7-6-8-13(14)18-15(20)11-10-12(11)16(21)19-17(2,3)4/h6-9,11-12H,5,10H2,1-4H3,(H,18,20)(H,19,21).
What are the key properties of 1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide?
1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide has a molecular weight of 304.39 g/mol, XLogP of 2.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109139628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).