N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide

C16H24N2O4S2 — CID 6503522

IUPACN-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide
SMILESO=C(NC1CCCCCC1)c1cc(S(=O)(=O)N2CCOCC2)cs1
InChIInChI=1S/C16H24N2O4S2/c19-16(17-13-5-3-1-2-4-6-13)15-11-14(12-23-15)24(20,21)18-7-9-22-10-8-18/h11-13H,1-10H2,(H,17,19)
InChIKeyGBUWAXHMGQCMAO-UHFFFAOYSA-N
MW372.51 g/mol
LogP2.22
Rot. Bonds4

About N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide

N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide (PubChem CID 6503522) has the molecular formula C16H24N2O4S2 and a molecular weight of 372.51 g/mol. Its IUPAC name is N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide
PubChem CID6503522
Molecular FormulaC16H24N2O4S2
Molecular Weight372.51 g/mol
Exact Mass372.12
IUPAC NameN-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide
SMILESO=C(NC1CCCCCC1)c1cc(S(=O)(=O)N2CCOCC2)cs1
InChIInChI=1S/C16H24N2O4S2/c19-16(17-13-5-3-1-2-4-6-13)15-11-14(12-23-15)24(20,21)18-7-9-22-10-8-18/h11-13H,1-10H2,(H,17,19)
InChIKeyGBUWAXHMGQCMAO-UHFFFAOYSA-N
XLogP2.22
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.51
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclohexyl-4-morpholin-4-ylsulfonyl-1H-pyrrole-2-carboxamide
CID 18108637
N-cycloheptyl-4-morpholin-4-ylsulfonyl-1H-pyrrole-2-carboxamide
CID 18107883
N-cyclopentyl-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide
CID 6503835
4-morpholin-4-ylsulfonylthiophene-2-carboxamide
CID 6486031
N-cyclohexyl-5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylbenzamide
CID 4825496
4-(azepan-1-ylsulfonyl)-N-methylthiophene-2-carboxamide
CID 6503439
1-(4-morpholin-4-ylsulfonylthiophene-2-carbonyl)piperidine-4-carboxylic acid
CID 27261011
N-(4-chloro-2,5-dimethoxyphenyl)-4-morpholin-4-ylsulfonylthiophene-2-carboxamide
CID 16761905
N-cycloheptyl-2-(4-fluorophenyl)sulfanyl-5-morpholin-4-ylsulfonylbenzamide
CID 3318997
N-(2-hydroxy-5-methylphenyl)-4-morpholin-4-ylsulfonylthiophene-2-carboxamide
CID 6503499
4-piperidin-1-ylsulfonyl-N-propan-2-ylthiophene-2-carboxamide
CID 6503269
4-(4-methylpiperidin-1-yl)sulfonyl-N-propan-2-ylthiophene-2-carboxamide
CID 6503399

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide?
The IUPAC name of N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide (CID 6503522) is N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide.
What is the SMILES notation for N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide?
The canonical SMILES for N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide is O=C(NC1CCCCCC1)c1cc(S(=O)(=O)N2CCOCC2)cs1.
What is the InChIKey of N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide?
The InChIKey is GBUWAXHMGQCMAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4S2/c19-16(17-13-5-3-1-2-4-6-13)15-11-14(12-23-15)24(20,21)18-7-9-22-10-8-18/h11-13H,1-10H2,(H,17,19).
What are the key properties of N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide?
N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide has a molecular weight of 372.51 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-4-morpholin-4-ylsulfonylthiophene-2-carboxamide is sourced from PubChem (CID 6503522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).