N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide

C16H15FN2OS — CID 32647564

IUPACN-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
SMILESCCN(Cc1cccs1)C(=O)c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C16H15FN2OS/c1-2-19(10-13-4-3-7-21-13)16(20)15-9-11-8-12(17)5-6-14(11)18-15/h3-9,18H,2,10H2,1H3
InChIKeyLQIKYEICWODULY-UHFFFAOYSA-N
MW302.37 g/mol
LogP4.03
Rot. Bonds4

About N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide

N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide (PubChem CID 32647564) has the molecular formula C16H15FN2OS and a molecular weight of 302.37 g/mol. Its IUPAC name is N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
PubChem CID32647564
Molecular FormulaC16H15FN2OS
Molecular Weight302.37 g/mol
Exact Mass302.09
IUPAC NameN-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
SMILESCCN(Cc1cccs1)C(=O)c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C16H15FN2OS/c1-2-19(10-13-4-3-7-21-13)16(20)15-9-11-8-12(17)5-6-14(11)18-15/h3-9,18H,2,10H2,1H3
InChIKeyLQIKYEICWODULY-UHFFFAOYSA-N
XLogP4.03
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-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-ethyl-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
CID 33032265
N-ethyl-4-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 60655445
5-fluoro-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide
CID 46555986
N-ethyl-1-oxo-N-(thiophen-2-ylmethyl)-2H-isoquinoline-3-carboxamide
CID 33032493
N-ethyl-N-[(3-fluorophenyl)methyl]-1H-indole-2-carboxamide
CID 51190000
2-[(5-fluoro-1H-indole-2-carbonyl)-propylamino]acetic acid
CID 119205230
1-ethyl-3-(4-fluorophenyl)-1-(thiophen-2-ylmethyl)urea
CID 27871706
N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 134014370
N-ethyl-6-(4-fluorophenyl)-3-methyl-N-(thiophen-2-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134036791
N-ethyl-2-(4-fluorophenoxy)-N-(thiophen-2-ylmethyl)acetamide
CID 67512148
N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 79770274
N-benzyl-5-fluoro-N-(2-methoxyethyl)-1H-indole-2-carboxamide
CID 39999780

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide?
The IUPAC name of N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide (CID 32647564) is N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide is CCN(Cc1cccs1)C(=O)c1cc2cc(F)ccc2[nH]1.
What is the InChIKey of N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide?
The InChIKey is LQIKYEICWODULY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2OS/c1-2-19(10-13-4-3-7-21-13)16(20)15-9-11-8-12(17)5-6-14(11)18-15/h3-9,18H,2,10H2,1H3.
What are the key properties of N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide?
N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide has a molecular weight of 302.37 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-fluoro-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 32647564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).