N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide

C17H17N3O5S — CID 112526632

IUPACN-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
SMILESO=C(Nc1cccc2cc[nH]c12)c1ccc(S(=O)(=O)N2CCOCC2)o1
InChIInChI=1S/C17H17N3O5S/c21-17(19-13-3-1-2-12-6-7-18-16(12)13)14-4-5-15(25-14)26(22,23)20-8-10-24-11-9-20/h1-7,18H,8-11H2,(H,19,21)
InChIKeyNGWHHWHTWBQSCR-UHFFFAOYSA-N
MW375.41 g/mol
LogP2.03
Rot. Bonds4

About N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide

N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide (PubChem CID 112526632) has the molecular formula C17H17N3O5S and a molecular weight of 375.41 g/mol. Its IUPAC name is N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
PubChem CID112526632
Molecular FormulaC17H17N3O5S
Molecular Weight375.41 g/mol
Exact Mass375.09
IUPAC NameN-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
SMILESO=C(Nc1cccc2cc[nH]c12)c1ccc(S(=O)(=O)N2CCOCC2)o1
InChIInChI=1S/C17H17N3O5S/c21-17(19-13-3-1-2-12-6-7-18-16(12)13)14-4-5-15(25-14)26(22,23)20-8-10-24-11-9-20/h1-7,18H,8-11H2,(H,19,21)
InChIKeyNGWHHWHTWBQSCR-UHFFFAOYSA-N
XLogP2.03
TPSA104.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.41
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-hydroxyphenyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 84578663
5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide
CID 112522783
5-morpholin-4-ylsulfonyl-N-(2,4,6-trimethylphenyl)furan-2-carboxamide
CID 39087927
5-piperidin-1-ylsulfonyl-N-(2-piperidin-1-ylsulfonylphenyl)furan-2-carboxamide
CID 55920724
N-(1H-indazol-3-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 112527883
N-(2-methyl-4-morpholin-4-ylphenyl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide
CID 55632664
N-[2-methyl-3-(methylcarbamoyl)phenyl]-5-pyrrolidin-1-ylsulfonylfuran-2-carboxamide
CID 46461599
N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 35993608
N-[2-methyl-3-(methylcarbamoyl)phenyl]-5-piperidin-1-ylsulfonylfuran-2-carboxamide
CID 55660521
N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 110476324
methyl 2-hydroxy-3-[(5-piperidin-1-ylsulfonylfuran-2-carbonyl)amino]benzoate
CID 56576104
5-morpholin-4-ylsulfonyl-N-(2-phenoxyethyl)furan-2-carboxamide
CID 30233770

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The IUPAC name of N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide (CID 112526632) is N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide.
What is the SMILES notation for N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The canonical SMILES for N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide is O=C(Nc1cccc2cc[nH]c12)c1ccc(S(=O)(=O)N2CCOCC2)o1.
What is the InChIKey of N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The InChIKey is NGWHHWHTWBQSCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O5S/c21-17(19-13-3-1-2-12-6-7-18-16(12)13)14-4-5-15(25-14)26(22,23)20-8-10-24-11-9-20/h1-7,18H,8-11H2,(H,19,21).
What are the key properties of N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide has a molecular weight of 375.41 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-7-yl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide is sourced from PubChem (CID 112526632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).