2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide

C19H17N3O2 — CID 109140997

IUPAC2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide
SMILESCc1ccccc1NC(=O)C1CC1C(=O)Nc1cccc(C#N)c1
InChIInChI=1S/C19H17N3O2/c1-12-5-2-3-8-17(12)22-19(24)16-10-15(16)18(23)21-14-7-4-6-13(9-14)11-20/h2-9,15-16H,10H2,1H3,(H,21,23)(H,22,24)
InChIKeyOWUMXYKPPLYZOX-UHFFFAOYSA-N
MW319.36 g/mol
LogP3.08
Rot. Bonds4

About 2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide

2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide (PubChem CID 109140997) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is 2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide
PubChem CID109140997
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC Name2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide
SMILESCc1ccccc1NC(=O)C1CC1C(=O)Nc1cccc(C#N)c1
InChIInChI=1S/C19H17N3O2/c1-12-5-2-3-8-17(12)22-19(24)16-10-15(16)18(23)21-14-7-4-6-13(9-14)11-20/h2-9,15-16H,10H2,1H3,(H,21,23)(H,22,24)
InChIKeyOWUMXYKPPLYZOX-UHFFFAOYSA-N
XLogP3.08
TPSA81.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-(3-cyanophenyl)-2-N-(3-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141101
1-N-(3-cyanophenyl)-2-N-(4-methoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143462
1-N-(3-cyanophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide
CID 109130608
1-N-(3-cyanophenyl)-2-N-(4-propan-2-yloxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143641
1-N-(3-cyanophenyl)-2-N-(2-methoxyethyl)cyclopropane-1,2-dicarboxamide
CID 109133078
1-N-(2,3-dimethylphenyl)-2-N-phenylcyclopropane-1,2-dicarboxamide
CID 109140804
(1R,2R,4S)-N-(3-cyanophenyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 98368145
1-N-(3-cyanophenyl)-2-N-[(2-fluorophenyl)methyl]cyclopropane-1,2-dicarboxamide
CID 109136011
2-N-(3-chloro-4-methoxyphenyl)-1-N-(3-cyanophenyl)cyclopropane-1,2-dicarboxamide
CID 109143267
N-(3-cyanophenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide
CID 9038792
2-N-(4-chlorophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109140926
2-N-(2-cyanophenyl)-1-N-(2,6-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141896

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide?
The IUPAC name of 2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide (CID 109140997) is 2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide is Cc1ccccc1NC(=O)C1CC1C(=O)Nc1cccc(C#N)c1.
What is the InChIKey of 2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide?
The InChIKey is OWUMXYKPPLYZOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c1-12-5-2-3-8-17(12)22-19(24)16-10-15(16)18(23)21-14-7-4-6-13(9-14)11-20/h2-9,15-16H,10H2,1H3,(H,21,23)(H,22,24).
What are the key properties of 2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide?
2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide has a molecular weight of 319.36 g/mol, XLogP of 3.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-cyanophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109140997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).