N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide

C19H17F3N4O2 — CID 155411931

IUPACN,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide
SMILESCN(C)C(=O)c1cc(NC(=O)Nc2ccc(C(F)(F)F)cc2)cc2[nH]ccc12
InChIInChI=1S/C19H17F3N4O2/c1-26(2)17(27)15-9-13(10-16-14(15)7-8-23-16)25-18(28)24-12-5-3-11(4-6-12)19(20,21)22/h3-10,23H,1-2H3,(H2,24,25,28)
InChIKeyVZPRVOWYJIIEDF-UHFFFAOYSA-N
MW390.37 g/mol
LogP4.53
Rot. Bonds3

About N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide

N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide (PubChem CID 155411931) has the molecular formula C19H17F3N4O2 and a molecular weight of 390.37 g/mol. Its IUPAC name is N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide
PubChem CID155411931
Molecular FormulaC19H17F3N4O2
Molecular Weight390.37 g/mol
Exact Mass390.13
IUPAC NameN,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide
SMILESCN(C)C(=O)c1cc(NC(=O)Nc2ccc(C(F)(F)F)cc2)cc2[nH]ccc12
InChIInChI=1S/C19H17F3N4O2/c1-26(2)17(27)15-9-13(10-16-14(15)7-8-23-16)25-18(28)24-12-5-3-11(4-6-12)19(20,21)22/h3-10,23H,1-2H3,(H2,24,25,28)
InChIKeyVZPRVOWYJIIEDF-UHFFFAOYSA-N
XLogP4.53
TPSA77.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.37
LogP ≤ 54.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-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

methyl 6-(phenylcarbamoylamino)-1H-indole-4-carboxylate
CID 166209612
N-methyl-2-[6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indol-3-yl]acetamide
CID 155412401
1-(4-chloro-3-fluoro-1H-indol-6-yl)-3-[4-(trifluoromethyl)phenyl]urea
CID 155412414
1-[3-(dimethylamino)propyl]-3-[4-(trifluoromethyl)phenyl]urea
CID 108896244
6-fluoro-N-[4-(trifluoromethyl)phenyl]-1H-indole-3-carboxamide
CID 113206284
methyl 6-[(4,5-dimethyl-1H-pyrazol-3-yl)carbamoylamino]-1H-indole-4-carboxylate
CID 167865415
6-methoxy-N-[4-(trifluoromethyl)phenyl]-1H-indole-3-carboxamide
CID 113206647
1-(1H-indazol-6-yl)-3-[4-(trifluoromethyl)phenyl]urea
CID 108896278
1-(4-propan-2-ylphenyl)-3-[4-(trifluoromethyl)phenyl]urea
CID 98000604
1-(2-aminopropyl)-3-[4-(trifluoromethyl)phenyl]urea
CID 63732530
4-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzamide
CID 108896282
1-(cyanomethyl)-3-[4-(trifluoromethyl)phenyl]urea
CID 61314990

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide?
The IUPAC name of N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide (CID 155411931) is N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide.
What is the SMILES notation for N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide?
The canonical SMILES for N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide is CN(C)C(=O)c1cc(NC(=O)Nc2ccc(C(F)(F)F)cc2)cc2[nH]ccc12.
What is the InChIKey of N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide?
The InChIKey is VZPRVOWYJIIEDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F3N4O2/c1-26(2)17(27)15-9-13(10-16-14(15)7-8-23-16)25-18(28)24-12-5-3-11(4-6-12)19(20,21)22/h3-10,23H,1-2H3,(H2,24,25,28).
What are the key properties of N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide?
N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide has a molecular weight of 390.37 g/mol, XLogP of 4.53, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1H-indole-4-carboxamide is sourced from PubChem (CID 155411931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).