N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide

C15H18N4OS — CID 104938281

IUPACN-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide
SMILESCC(C)Cc1nnc(NC(=O)c2ccc3c(c2)CCN3)s1
InChIInChI=1S/C15H18N4OS/c1-9(2)7-13-18-19-15(21-13)17-14(20)11-3-4-12-10(8-11)5-6-16-12/h3-4,8-9,16H,5-7H2,1-2H3,(H,17,19,20)
InChIKeyOQUAVPWDKHYMIO-UHFFFAOYSA-N
MW302.40 g/mol
LogP2.96
Rot. Bonds4

About N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide

N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 104938281) has the molecular formula C15H18N4OS and a molecular weight of 302.40 g/mol. Its IUPAC name is N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID104938281
Molecular FormulaC15H18N4OS
Molecular Weight302.40 g/mol
Exact Mass302.12
IUPAC NameN-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide
SMILESCC(C)Cc1nnc(NC(=O)c2ccc3c(c2)CCN3)s1
InChIInChI=1S/C15H18N4OS/c1-9(2)7-13-18-19-15(21-13)17-14(20)11-3-4-12-10(8-11)5-6-16-12/h3-4,8-9,16H,5-7H2,1-2H3,(H,17,19,20)
InChIKeyOQUAVPWDKHYMIO-UHFFFAOYSA-N
XLogP2.96
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-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-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 108797970
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 134055670
N-(4-propan-2-yl-1,3-thiazol-2-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 61482478
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 61474388
3-methoxy-4-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 51228862
3-acetamido-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 51148570
4-ethoxy-3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 86937929
4-chloro-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-3-methylsulfonylbenzamide
CID 31289416
3-[(4-fluorophenyl)methoxy]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 24647665
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-(trifluoromethoxy)benzamide
CID 26068513
N-[(2S)-2-hydroxypropyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 93083353
5-iodo-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]thiophene-3-carboxamide
CID 113233248

Frequently Asked Questions

What is the IUPAC name of N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide (CID 104938281) is N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide is CC(C)Cc1nnc(NC(=O)c2ccc3c(c2)CCN3)s1.
What is the InChIKey of N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is OQUAVPWDKHYMIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4OS/c1-9(2)7-13-18-19-15(21-13)17-14(20)11-3-4-12-10(8-11)5-6-16-12/h3-4,8-9,16H,5-7H2,1-2H3,(H,17,19,20).
What are the key properties of N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide?
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 302.40 g/mol, XLogP of 2.96, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 104938281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).