2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane

C16H24N4O2S2 — CID 143433766

IUPAC2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane
SMILESCC.CC(C)c1nnc(NS(=O)(=O)c2ccc3c(c2)CC(N)C3)s1
InChIInChI=1S/C14H18N4O2S2.C2H6/c1-8(2)13-16-17-14(21-13)18-22(19,20)12-4-3-9-5-11(15)6-10(9)7-12;1-2/h3-4,7-8,11H,5-6,15H2,1-2H3,(H,17,18);1-2H3
InChIKeySRXQPZZQKQJEGL-UHFFFAOYSA-N
MW368.53 g/mol
LogP2.91
Rot. Bonds4

About 2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane

2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane (PubChem CID 143433766) has the molecular formula C16H24N4O2S2 and a molecular weight of 368.53 g/mol. Its IUPAC name is 2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane.

Molecular Properties

Compound Name2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane
PubChem CID143433766
Molecular FormulaC16H24N4O2S2
Molecular Weight368.53 g/mol
Exact Mass368.13
IUPAC Name2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane
SMILESCC.CC(C)c1nnc(NS(=O)(=O)c2ccc3c(c2)CC(N)C3)s1
InChIInChI=1S/C14H18N4O2S2.C2H6/c1-8(2)13-16-17-14(21-13)18-22(19,20)12-4-3-9-5-11(15)6-10(9)7-12;1-2/h3-4,7-8,11H,5-6,15H2,1-2H3,(H,17,18);1-2H3
InChIKeySRXQPZZQKQJEGL-UHFFFAOYSA-N
XLogP2.91
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.53
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 35539040
(2R)-2-amino-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide
CID 95804126
4-methoxy-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
CID 750627
N-[(2S)-2-[4-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]cyclopentyl]acetamide
CID 143823201
2-chloro-5-fluoro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
CID 71974664
N-[5-[1-[(4-chlorophenyl)sulfonylamino]ethyl]-1,3,4-thiadiazol-2-yl]-4-methylbenzenesulfonamide
CID 135391827
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 35539045
3-amino-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzenesulfonamide
CID 20983490
4-ethyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
CID 25041652
4-chloro-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzenesulfonamide
CID 697506
4-hydroxy-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzenesulfonamide
CID 106261423
N-(5-methyl-1,3-thiazol-2-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 35523329

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane?
The IUPAC name of 2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane (CID 143433766) is 2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane.
What is the SMILES notation for 2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane?
The canonical SMILES for 2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane is CC.CC(C)c1nnc(NS(=O)(=O)c2ccc3c(c2)CC(N)C3)s1.
What is the InChIKey of 2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane?
The InChIKey is SRXQPZZQKQJEGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2S2.C2H6/c1-8(2)13-16-17-14(21-13)18-22(19,20)12-4-3-9-5-11(15)6-10(9)7-12;1-2/h3-4,7-8,11H,5-6,15H2,1-2H3,(H,17,18);1-2H3.
What are the key properties of 2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane?
2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane has a molecular weight of 368.53 g/mol, XLogP of 2.91, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-indene-5-sulfonamide;ethane is sourced from PubChem (CID 143433766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).