N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide

C15H15N3OS — CID 33033043

IUPACN-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide
SMILESCCN(Cc1cccs1)C(=O)c1cccc2cn[nH]c12
InChIInChI=1S/C15H15N3OS/c1-2-18(10-12-6-4-8-20-12)15(19)13-7-3-5-11-9-16-17-14(11)13/h3-9H,2,10H2,1H3,(H,16,17)
InChIKeyDIFACDVKPBGRJM-UHFFFAOYSA-N
MW285.37 g/mol
LogP3.29
Rot. Bonds4

About N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide

N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide (PubChem CID 33033043) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide
PubChem CID33033043
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC NameN-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide
SMILESCCN(Cc1cccs1)C(=O)c1cccc2cn[nH]c12
InChIInChI=1S/C15H15N3OS/c1-2-18(10-12-6-4-8-20-12)15(19)13-7-3-5-11-9-16-17-14(11)13/h3-9H,2,10H2,1H3,(H,16,17)
InChIKeyDIFACDVKPBGRJM-UHFFFAOYSA-N
XLogP3.29
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-fluoro-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 107358620
6-[ethyl(thiophen-2-ylmethyl)carbamoyl]pyridine-2-carboxylic acid
CID 61437390
2-chloro-N-ethyl-N-(thiophen-2-ylmethyl)furan-3-carboxamide
CID 106686239
2-amino-N-ethyl-3-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 62660536
N-ethyl-2-(ethylamino)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 62175045
N-ethyl-4-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 60655445
N-ethyl-2,4-dihydroxy-N-(thiophen-2-ylmethyl)benzamide
CID 103602482
N-ethyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide
CID 60659716
N-ethyl-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
CID 33032265
N-ethyl-2-hydroxy-5-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 60655389
N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 134014370
N-(1H-indazol-7-yl)-2-thiophen-2-ylacetamide
CID 110472568

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide?
The IUPAC name of N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide (CID 33033043) is N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide.
What is the SMILES notation for N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide?
The canonical SMILES for N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide is CCN(Cc1cccs1)C(=O)c1cccc2cn[nH]c12.
What is the InChIKey of N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide?
The InChIKey is DIFACDVKPBGRJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-2-18(10-12-6-4-8-20-12)15(19)13-7-3-5-11-9-16-17-14(11)13/h3-9H,2,10H2,1H3,(H,16,17).
What are the key properties of N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide?
N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide has a molecular weight of 285.37 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(thiophen-2-ylmethyl)-1H-indazole-7-carboxamide is sourced from PubChem (CID 33033043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).