6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide

C15H15N3OS — CID 61095599

IUPAC6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide
SMILESCN(Cc1cccs1)C(=O)c1c[nH]c2cc(N)ccc12
InChIInChI=1S/C15H15N3OS/c1-18(9-11-3-2-6-20-11)15(19)13-8-17-14-7-10(16)4-5-12(13)14/h2-8,17H,9,16H2,1H3
InChIKeyRTPWAYTXGYZTIP-UHFFFAOYSA-N
MW285.37 g/mol
LogP3.08
Rot. Bonds3

About 6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide

6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide (PubChem CID 61095599) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is 6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide
PubChem CID61095599
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC Name6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide
SMILESCN(Cc1cccs1)C(=O)c1c[nH]c2cc(N)ccc12
InChIInChI=1S/C15H15N3OS/c1-18(9-11-3-2-6-20-11)15(19)13-8-17-14-7-10(16)4-5-12(13)14/h2-8,17H,9,16H2,1H3
InChIKeyRTPWAYTXGYZTIP-UHFFFAOYSA-N
XLogP3.08
TPSA62.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

6-amino-N-methyl-N-(pyridin-4-ylmethyl)-1H-indole-3-carboxamide
CID 61095235
4-amino-2-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 43527196
6-amino-N-(2-hydroxypropyl)-N-methyl-1H-indole-3-carboxamide
CID 62334013
6-amino-N-methyl-N-propyl-1H-indole-3-carboxamide
CID 61094974
6-amino-N-[2-(dimethylamino)ethyl]-N-methyl-1H-indole-3-carboxamide
CID 63694066
3-amino-N-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 43527201
5-amino-N-[(4-bromothiophen-2-yl)methyl]-N-methyl-1H-indole-3-carboxamide
CID 63116787
6-amino-N-[(1-hydroxycyclopentyl)methyl]-N-methyl-1H-indole-3-carboxamide
CID 114946750
N-ethyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide
CID 60659716
3-amino-N,2-dimethyl-N-(thiophen-2-ylmethyl)benzamide
CID 43527192
5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
CID 79475810
1-(1H-indol-3-yl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone
CID 60650536

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide?
The IUPAC name of 6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide (CID 61095599) is 6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide.
What is the SMILES notation for 6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide?
The canonical SMILES for 6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide is CN(Cc1cccs1)C(=O)c1c[nH]c2cc(N)ccc12.
What is the InChIKey of 6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide?
The InChIKey is RTPWAYTXGYZTIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-18(9-11-3-2-6-20-11)15(19)13-8-17-14-7-10(16)4-5-12(13)14/h2-8,17H,9,16H2,1H3.
What are the key properties of 6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide?
6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide has a molecular weight of 285.37 g/mol, XLogP of 3.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-methyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide is sourced from PubChem (CID 61095599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).