6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide

C10H11F2NO — CID 68949408

IUPAC6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide
SMILESNC(=O)C1C=CC(F)=CC1(F)C1CC1
InChIInChI=1S/C10H11F2NO/c11-7-3-4-8(9(13)14)10(12,5-7)6-1-2-6/h3-6,8H,1-2H2,(H2,13,14)
InChIKeyPSDGPUYZGZJXEG-UHFFFAOYSA-N
MW199.20 g/mol
LogP1.63
Rot. Bonds2

About 6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide

6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide (PubChem CID 68949408) has the molecular formula C10H11F2NO and a molecular weight of 199.20 g/mol. Its IUPAC name is 6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide
PubChem CID68949408
Molecular FormulaC10H11F2NO
Molecular Weight199.20 g/mol
Exact Mass199.08
IUPAC Name6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide
SMILESNC(=O)C1C=CC(F)=CC1(F)C1CC1
InChIInChI=1S/C10H11F2NO/c11-7-3-4-8(9(13)14)10(12,5-7)6-1-2-6/h3-6,8H,1-2H2,(H2,13,14)
InChIKeyPSDGPUYZGZJXEG-UHFFFAOYSA-N
XLogP1.63
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.20
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide 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

2-cyclohex-3-en-1-yl-N,2,2-trifluoroacetamide
CID 20522320
6-Cyclopropyl-6-fluorocyclohexa-2,4-diene-1-carboxamide
CID 66666374
6-Cyclopropyl-6-(trifluoromethyl)cyclohexa-2,4-diene-1-carboxamide
CID 67173455
6-Cyclopropyl-2,3,4,5,6-pentafluorocyclohexa-2,4-diene-1-carboxamide
CID 68941080
6-Ethyl-6-(trifluoromethyl)cyclohexa-2,4-diene-1-carboxamide
CID 69543217
6-Ethyl-6-fluorocyclohexa-2,4-diene-1-carboxamide
CID 69708078
2-(6,6-Difluorocyclohexa-2,4-dien-1-yl)acetamide
CID 70416183
3-[6-(Cyclopropylmethyl)cyclohex-2-en-1-yl]-4,4,4-trifluorobutanamide
CID 117721532
6-Tert-butyl-6-fluorocyclohexa-2,4-diene-1-carboxamide
CID 122604237
2-(5-Fluoro-6-methylidenecyclohexa-2,4-dien-1-yl)acetamide
CID 139765755
2-(4-Fluoro-6-methylidenecyclohexa-2,4-dien-1-yl)acetamide
CID 139765773
5-Cyclopropyl-4,5-difluorocyclohexa-1,3-diene-1-carboxamide
CID 142788435

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide?
The IUPAC name of 6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide (CID 68949408) is 6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide.
What is the SMILES notation for 6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide?
The canonical SMILES for 6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide is NC(=O)C1C=CC(F)=CC1(F)C1CC1.
What is the InChIKey of 6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide?
The InChIKey is PSDGPUYZGZJXEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO/c11-7-3-4-8(9(13)14)10(12,5-7)6-1-2-6/h3-6,8H,1-2H2,(H2,13,14).
What are the key properties of 6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide?
6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide has a molecular weight of 199.20 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-4,6-difluorocyclohexa-2,4-diene-1-carboxamide is sourced from PubChem (CID 68949408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).