N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide

C11H13NOS — CID 60650065

IUPACN-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide
SMILESO=C(CS)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C11H13NOS/c13-11(7-14)12-10-5-4-8-2-1-3-9(8)6-10/h4-6,14H,1-3,7H2,(H,12,13)
InChIKeyPJPFWGAYYAQGLX-UHFFFAOYSA-N
MW207.30 g/mol
LogP2.04
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide

N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide (PubChem CID 60650065) has the molecular formula C11H13NOS and a molecular weight of 207.30 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide
PubChem CID60650065
Molecular FormulaC11H13NOS
Molecular Weight207.30 g/mol
Exact Mass207.07
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide
SMILESO=C(CS)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C11H13NOS/c13-11(7-14)12-10-5-4-8-2-1-3-9(8)6-10/h4-6,14H,1-3,7H2,(H,12,13)
InChIKeyPJPFWGAYYAQGLX-UHFFFAOYSA-N
XLogP2.04
TPSA29.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_2', 'substructure': 'N/A'}

Analyze N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide 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

2-sulfanyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 115166897
N-(5,6,7,8-tetrahydronaphthalen-2-yl)propanamide
CID 59873074
N-(3,4-dihydro-2H-chromen-6-yl)-2-sulfanylacetamide
CID 115166948
N-(2,3-dihydro-1H-inden-5-yl)-5-hydroxypentanamide
CID 79199175
(3Z)-3-amino-N-(2,3-dihydro-1H-inden-5-yl)-3-hydroxyiminopropanamide
CID 43156060
N-(2,3-dihydro-1H-inden-5-yl)-2-pyrrolidin-1-ylacetamide
CID 1429488
2-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-5-yl)acetamide
CID 2634509
2-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]acetic acid
CID 650247
N-(2,3-dihydro-1H-inden-5-yl)-2-(4-hydroxyphenyl)sulfanylacetamide
CID 61031459
7-amino-N-(2,3-dihydro-1H-inden-5-yl)heptanamide
CID 24700487
N-(2,3-dihydro-1H-inden-5-yl)-3-phenylpropanamide
CID 4239191
3-amino-N-(2,3-dihydro-1H-inden-5-yl)butanamide;hydrochloride
CID 119678186

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide (CID 60650065) is N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide is O=C(CS)Nc1ccc2c(c1)CCC2.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide?
The InChIKey is PJPFWGAYYAQGLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NOS/c13-11(7-14)12-10-5-4-8-2-1-3-9(8)6-10/h4-6,14H,1-3,7H2,(H,12,13).
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide?
N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide has a molecular weight of 207.30 g/mol, XLogP of 2.04, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide is sourced from PubChem (CID 60650065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).