1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide

C19H22N2O4S — CID 53160204

IUPAC1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide
SMILESCOc1ccc(S(=O)(=O)N2CCc3c(C(=O)NC(C)C)cccc32)cc1
InChIInChI=1S/C19H22N2O4S/c1-13(2)20-19(22)17-5-4-6-18-16(17)11-12-21(18)26(23,24)15-9-7-14(25-3)8-10-15/h4-10,13H,11-12H2,1-3H3,(H,20,22)
InChIKeyFRNVDWCBOKEVLA-UHFFFAOYSA-N
MW374.46 g/mol
LogP2.58
Rot. Bonds5

About 1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide

1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide (PubChem CID 53160204) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide.

Molecular Properties

Compound Name1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide
PubChem CID53160204
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC Name1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide
SMILESCOc1ccc(S(=O)(=O)N2CCc3c(C(=O)NC(C)C)cccc32)cc1
InChIInChI=1S/C19H22N2O4S/c1-13(2)20-19(22)17-5-4-6-18-16(17)11-12-21(18)26(23,24)15-9-7-14(25-3)8-10-15/h4-10,13H,11-12H2,1-3H3,(H,20,22)
InChIKeyFRNVDWCBOKEVLA-UHFFFAOYSA-N
XLogP2.58
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindol-4-yl]-pyrrolidin-1-ylmethanone
CID 53160216
1-(4-chlorophenyl)sulfonyl-N-[(1R)-1-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-quinoline-6-carboxamide
CID 100770223
(4-methoxyphenyl) 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate
CID 8881484
3-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]propanamide
CID 28557583
N-[1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]-3-methylbenzamide
CID 27537420
1-N-(4-methoxyphenyl)-4-N-(1-pyridin-2-ylethyl)-2,3-dihydroindole-1,4-dicarboxamide
CID 53200908
7-methoxy-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinolin-4-one
CID 110635683
(2S)-4-(4-methoxyphenyl)sulfonyl-N-[(2S)-3-methylbutan-2-yl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide
CID 100569575
(E)-N-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-3-(4-methoxyphenyl)prop-2-enamide
CID 1291625
N-[1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]-3-methylbutanamide
CID 27368896
methyl N-[1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]carbamate
CID 16835393
6-(4-methoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-1,5-naphthyridine
CID 56588648

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide?
The IUPAC name of 1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide (CID 53160204) is 1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide.
What is the SMILES notation for 1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide?
The canonical SMILES for 1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide is COc1ccc(S(=O)(=O)N2CCc3c(C(=O)NC(C)C)cccc32)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide?
The InChIKey is FRNVDWCBOKEVLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c1-13(2)20-19(22)17-5-4-6-18-16(17)11-12-21(18)26(23,24)15-9-7-14(25-3)8-10-15/h4-10,13H,11-12H2,1-3H3,(H,20,22).
What are the key properties of 1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide?
1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide has a molecular weight of 374.46 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)sulfonyl-N-propan-2-yl-2,3-dihydroindole-4-carboxamide is sourced from PubChem (CID 53160204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).