N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide

C20H20F2N2O2 — CID 55930331

IUPACN-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide
SMILESCCn1c(C(=O)NCCc2ccc(OC(F)F)cc2)cc2ccccc21
InChIInChI=1S/C20H20F2N2O2/c1-2-24-17-6-4-3-5-15(17)13-18(24)19(25)23-12-11-14-7-9-16(10-8-14)26-20(21)22/h3-10,13,20H,2,11-12H2,1H3,(H,23,25)
InChIKeyCSTBRZLQLKRKKU-UHFFFAOYSA-N
MW358.39 g/mol
LogP4.24
Rot. Bonds7

About N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide

N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide (PubChem CID 55930331) has the molecular formula C20H20F2N2O2 and a molecular weight of 358.39 g/mol. Its IUPAC name is N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide.

Molecular Properties

Compound NameN-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide
PubChem CID55930331
Molecular FormulaC20H20F2N2O2
Molecular Weight358.39 g/mol
Exact Mass358.15
IUPAC NameN-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide
SMILESCCn1c(C(=O)NCCc2ccc(OC(F)F)cc2)cc2ccccc21
InChIInChI=1S/C20H20F2N2O2/c1-2-24-17-6-4-3-5-15(17)13-18(24)19(25)23-12-11-14-7-9-16(10-8-14)26-20(21)22/h3-10,13,20H,2,11-12H2,1H3,(H,23,25)
InChIKeyCSTBRZLQLKRKKU-UHFFFAOYSA-N
XLogP4.24
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.39
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-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

N-[2-[4-(difluoromethoxy)phenyl]ethyl]-3-methoxynaphthalene-2-carboxamide
CID 18225243
1-ethyl-N-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]indole-2-carboxamide
CID 52522890
1-ethylindole-2-carbohydrazide
CID 166595239
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-2-oxochromene-3-carboxamide
CID 51201859
(2S)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]-2-methylbutanamide
CID 94018114
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-4-methylbenzamide
CID 7997620
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethylamino)acetamide
CID 78912541
1-ethyl-N-[[1-(1-hydroxy-2-methylpropyl)cyclopropyl]methyl]indole-2-carboxamide
CID 75444716
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-3-(methoxymethyl)benzamide
CID 51201923
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-2-hydroxy-4-methoxybenzamide
CID 27884454
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-2-[[(1R)-1-naphthalen-1-ylethyl]amino]acetamide
CID 8695568
N-[2-(4-chlorophenyl)ethyl]-4-(difluoromethoxy)benzamide
CID 27646459

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide?
The IUPAC name of N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide (CID 55930331) is N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide.
What is the SMILES notation for N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide?
The canonical SMILES for N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide is CCn1c(C(=O)NCCc2ccc(OC(F)F)cc2)cc2ccccc21.
What is the InChIKey of N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide?
The InChIKey is CSTBRZLQLKRKKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F2N2O2/c1-2-24-17-6-4-3-5-15(17)13-18(24)19(25)23-12-11-14-7-9-16(10-8-14)26-20(21)22/h3-10,13,20H,2,11-12H2,1H3,(H,23,25).
What are the key properties of N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide?
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide has a molecular weight of 358.39 g/mol, XLogP of 4.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide is sourced from PubChem (CID 55930331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).