2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide

C14H16N2O2 — CID 109130904

IUPAC2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide
SMILESO=C(Nc1ccccc1)C1CC1C(=O)NC1CC1
InChIInChI=1S/C14H16N2O2/c17-13(15-9-4-2-1-3-5-9)11-8-12(11)14(18)16-10-6-7-10/h1-5,10-12H,6-8H2,(H,15,17)(H,16,18)
InChIKeyRJYPSYRCTPUKOU-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.54
Rot. Bonds4

About 2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide

2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide (PubChem CID 109130904) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide
PubChem CID109130904
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide
SMILESO=C(Nc1ccccc1)C1CC1C(=O)NC1CC1
InChIInChI=1S/C14H16N2O2/c17-13(15-9-4-2-1-3-5-9)11-8-12(11)14(18)16-10-6-7-10/h1-5,10-12H,6-8H2,(H,15,17)(H,16,18)
InChIKeyRJYPSYRCTPUKOU-UHFFFAOYSA-N
XLogP1.54
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-cyclopropyl-1-N-(3-fluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109130976
1-N-(4-acetylphenyl)-2-N-cyclopropylcyclopropane-1,2-dicarboxamide
CID 109130958
1-N-(4-chlorophenyl)-2-N-cyclopentylcyclopropane-1,2-dicarboxamide
CID 109132096
2-N-cyclopropyl-1-N-(3,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109130914
2-N-cyclopropyl-1-N-(3,4-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109130913
trans-(1R,2R)-1-N,2-N-diphenylcyclohexane-1,2-dicarboxamide
CID 15685590
2-N-cyclopropyl-1-N-(2,6-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109130915
1-N-tert-butyl-2-N-phenylcyclopropane-1,2-dicarboxamide
CID 109139586
1-N-(2-cyanophenyl)-2-N-cyclopropylcyclopropane-1,2-dicarboxamide
CID 109131004
1-N-(3-chlorophenyl)-2-N-phenylcyclopropane-1,2-dicarboxamide
CID 109140819
2-N-cyclopropyl-1-N-(2,6-diethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109130924
2-N-cyclopropyl-1-N-[2,6-di(propan-2-yl)phenyl]cyclopropane-1,2-dicarboxamide
CID 109130984

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide?
The IUPAC name of 2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide (CID 109130904) is 2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide?
The canonical SMILES for 2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide is O=C(Nc1ccccc1)C1CC1C(=O)NC1CC1.
What is the InChIKey of 2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide?
The InChIKey is RJYPSYRCTPUKOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c17-13(15-9-4-2-1-3-5-9)11-8-12(11)14(18)16-10-6-7-10/h1-5,10-12H,6-8H2,(H,15,17)(H,16,18).
What are the key properties of 2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide?
2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide has a molecular weight of 244.29 g/mol, XLogP of 1.54, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-1-N-phenylcyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109130904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).