trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide

C19H14N4O2 — CID 124628395

IUPACtrans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide
SMILESN#Cc1ccc(NC(=O)[C@@H]2C[C@H]2C(=O)Nc2ccc(C#N)cc2)cc1
InChIInChI=1S/C19H14N4O2/c20-10-12-1-5-14(6-2-12)22-18(24)16-9-17(16)19(25)23-15-7-3-13(11-21)4-8-15/h1-8,16-17H,9H2,(H,22,24)(H,23,25)/t16-,17-/m1/s1
InChIKeyINUCYFDJSRGPAW-IAGOWNOFSA-N
MW330.35 g/mol
LogP2.64
Rot. Bonds4

About trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide

trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide (PubChem CID 124628395) has the molecular formula C19H14N4O2 and a molecular weight of 330.35 g/mol. Its IUPAC name is trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Nametrans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide
PubChem CID124628395
Molecular FormulaC19H14N4O2
Molecular Weight330.35 g/mol
Exact Mass330.11
IUPAC Nametrans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide
SMILESN#Cc1ccc(NC(=O)[C@@H]2C[C@H]2C(=O)Nc2ccc(C#N)cc2)cc1
InChIInChI=1S/C19H14N4O2/c20-10-12-1-5-14(6-2-12)22-18(24)16-9-17(16)19(25)23-15-7-3-13(11-21)4-8-15/h1-8,16-17H,9H2,(H,22,24)(H,23,25)/t16-,17-/m1/s1
InChIKeyINUCYFDJSRGPAW-IAGOWNOFSA-N
XLogP2.64
TPSA105.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N-(3-bromophenyl)-2-N-(4-cyanophenyl)cyclopropane-1,2-dicarboxamide
CID 109144038
1-N-(3-chloro-4-fluorophenyl)-2-N-(4-cyanophenyl)cyclopropane-1,2-dicarboxamide
CID 109143222
1-N-(4-cyanophenyl)-2-N-[2-(dimethylamino)ethyl]cyclopropane-1,2-dicarboxamide
CID 109133807
2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide
CID 109144193
1-N-(4-cyanophenyl)-2-N-(2-morpholin-4-ylethyl)cyclopropane-1,2-dicarboxamide
CID 109133953
N-(4-cyanophenyl)-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 115583698
N-(4-cyanophenyl)-4-(methylamino)oxolane-3-carboxamide
CID 66265960
N-(4-cyanophenyl)-2-(2-ethylpiperidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109140375
1-N-(3-cyanophenyl)-2-N-(4-methoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143462
(1S,6S)-6-[[4-(4-cyanophenoxy)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 1114570
N-(4-cyanophenyl)-2-methylpiperidine-4-carboxamide
CID 106738623
N-(4-cyanophenyl)-4-methylpiperidine-2-carboxamide
CID 114422665

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide?
The IUPAC name of trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide (CID 124628395) is trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide?
The canonical SMILES for trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide is N#Cc1ccc(NC(=O)[C@@H]2C[C@H]2C(=O)Nc2ccc(C#N)cc2)cc1.
What is the InChIKey of trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide?
The InChIKey is INUCYFDJSRGPAW-IAGOWNOFSA-N. The full InChI is InChI=1S/C19H14N4O2/c20-10-12-1-5-14(6-2-12)22-18(24)16-9-17(16)19(25)23-15-7-3-13(11-21)4-8-15/h1-8,16-17H,9H2,(H,22,24)(H,23,25)/t16-,17-/m1/s1.
What are the key properties of trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide?
trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide has a molecular weight of 330.35 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 124628395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).