N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide

C19H25NO3S — CID 71925231

IUPACN-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide
SMILESCS(=O)(=O)CC1(CC(=O)N(C2CC2)C2CCc3ccccc32)CC1
InChIInChI=1S/C19H25NO3S/c1-24(22,23)13-19(10-11-19)12-18(21)20(15-7-8-15)17-9-6-14-4-2-3-5-16(14)17/h2-5,15,17H,6-13H2,1H3
InChIKeyYZNQGOJTUXMTTP-UHFFFAOYSA-N
MW347.48 g/mol
LogP2.88
Rot. Bonds6

About N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide

N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide (PubChem CID 71925231) has the molecular formula C19H25NO3S and a molecular weight of 347.48 g/mol. Its IUPAC name is N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide
PubChem CID71925231
Molecular FormulaC19H25NO3S
Molecular Weight347.48 g/mol
Exact Mass347.16
IUPAC NameN-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide
SMILESCS(=O)(=O)CC1(CC(=O)N(C2CC2)C2CCc3ccccc32)CC1
InChIInChI=1S/C19H25NO3S/c1-24(22,23)13-19(10-11-19)12-18(21)20(15-7-8-15)17-9-6-14-4-2-3-5-16(14)17/h2-5,15,17H,6-13H2,1H3
InChIKeyYZNQGOJTUXMTTP-UHFFFAOYSA-N
XLogP2.88
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.48
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)propanamide
CID 119299896
4-amino-N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-3-methoxybutanamide;hydrochloride
CID 120589829
2-(4-aminophenyl)-N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride
CID 119742610
2-[(4-acetylphenyl)sulfonyl-methylamino]-N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)acetamide
CID 55865233
N-(2,3-dihydro-1H-inden-1-yl)-3-(methanesulfonamido)-N-methylpropanamide
CID 47175434
N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide
CID 119742625
4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide;hydrochloride
CID 120560475
2-[1-(methylsulfonylmethyl)cyclopropyl]-1-(1-propyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone
CID 84585617
2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide
CID 60522229
N',N'-bis[(1R)-2,3-dihydro-1H-inden-1-yl]butanediamide
CID 67417202
N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)-2-fluorobenzamide
CID 55864349
7-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)heptanamide;hydrochloride
CID 119728149

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide?
The IUPAC name of N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide (CID 71925231) is N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide.
What is the SMILES notation for N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide?
The canonical SMILES for N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide is CS(=O)(=O)CC1(CC(=O)N(C2CC2)C2CCc3ccccc32)CC1.
What is the InChIKey of N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide?
The InChIKey is YZNQGOJTUXMTTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO3S/c1-24(22,23)13-19(10-11-19)12-18(21)20(15-7-8-15)17-9-6-14-4-2-3-5-16(14)17/h2-5,15,17H,6-13H2,1H3.
What are the key properties of N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide?
N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide has a molecular weight of 347.48 g/mol, XLogP of 2.88, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-2-[1-(methylsulfonylmethyl)cyclopropyl]acetamide is sourced from PubChem (CID 71925231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).