N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide

C14H20N2OS — CID 112659434

IUPACN-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCSCC(C)N(C)C(=O)C1Cc2ccccc2N1
InChIInChI=1S/C14H20N2OS/c1-10(9-18-3)16(2)14(17)13-8-11-6-4-5-7-12(11)15-13/h4-7,10,13,15H,8-9H2,1-3H3
InChIKeyWWBGCKJADKUOBL-UHFFFAOYSA-N
MW264.39 g/mol
LogP2.23
Rot. Bonds4

About N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide

N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 112659434) has the molecular formula C14H20N2OS and a molecular weight of 264.39 g/mol. Its IUPAC name is N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID112659434
Molecular FormulaC14H20N2OS
Molecular Weight264.39 g/mol
Exact Mass264.13
IUPAC NameN-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCSCC(C)N(C)C(=O)C1Cc2ccccc2N1
InChIInChI=1S/C14H20N2OS/c1-10(9-18-3)16(2)14(17)13-8-11-6-4-5-7-12(11)15-13/h4-7,10,13,15H,8-9H2,1-3H3
InChIKeyWWBGCKJADKUOBL-UHFFFAOYSA-N
XLogP2.23
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-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

(2S)-N-(1-hydroxypropan-2-yl)-N-methyl-2,3-dihydro-1H-indole-2-carboxamide
CID 113426017
N-ethyl-N-methyl-2,3-dihydro-1H-indole-2-carboxamide
CID 76893209
N-methyl-N-(2-methylsulfanylethyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 112659062
N,N-dimethyl-2,3-dihydro-1H-indole-2-carboxamide
CID 18184482
(2S)-N-cyclopropyl-N-ethyl-2,3-dihydro-1H-indole-2-carboxamide
CID 61155358
(2S)-N-butyl-N-methyl-2,3-dihydro-1H-indole-2-carboxamide
CID 61148251
N-ethyl-N-(2-methylbutyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 80567400
N-cyclopropyl-N-propyl-2,3-dihydro-1H-indole-2-carboxamide
CID 76893036
(2S)-N-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2,3-dihydro-1H-indole-2-carboxamide
CID 61155725
(2S)-N-ethyl-N-(2-ethylbutyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61156300
1-[(2S)-2,3-dihydro-1H-indol-2-yl]propan-1-one
CID 67580634
N-(2-hydroxyethyl)-N-propan-2-yl-2,3-dihydro-1H-indole-2-carboxamide
CID 76893844

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide (CID 112659434) is N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide is CSCC(C)N(C)C(=O)C1Cc2ccccc2N1.
What is the InChIKey of N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is WWBGCKJADKUOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2OS/c1-10(9-18-3)16(2)14(17)13-8-11-6-4-5-7-12(11)15-13/h4-7,10,13,15H,8-9H2,1-3H3.
What are the key properties of N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide?
N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 264.39 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 112659434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).