4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide

C17H24N2O5S — CID 70769591

IUPAC4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide
SMILESO=C(NCC1(CO)CCOCC1)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C17H24N2O5S/c20-12-17(7-9-24-10-8-17)11-18-16(21)13-1-5-15(6-2-13)25(22,23)19-14-3-4-14/h1-2,5-6,14,19-20H,3-4,7-12H2,(H,18,21)
InChIKeyZULSKQJEFRCLMJ-UHFFFAOYSA-N
MW368.46 g/mol
LogP0.65
Rot. Bonds7

About 4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide

4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide (PubChem CID 70769591) has the molecular formula C17H24N2O5S and a molecular weight of 368.46 g/mol. Its IUPAC name is 4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide.

Molecular Properties

Compound Name4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide
PubChem CID70769591
Molecular FormulaC17H24N2O5S
Molecular Weight368.46 g/mol
Exact Mass368.14
IUPAC Name4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide
SMILESO=C(NCC1(CO)CCOCC1)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C17H24N2O5S/c20-12-17(7-9-24-10-8-17)11-18-16(21)13-1-5-15(6-2-13)25(22,23)19-14-3-4-14/h1-2,5-6,14,19-20H,3-4,7-12H2,(H,18,21)
InChIKeyZULSKQJEFRCLMJ-UHFFFAOYSA-N
XLogP0.65
TPSA104.73 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.46
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

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4-(oxan-4-ylsulfamoyl)-N-(oxolan-3-yl)benzamide
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CID 34508335
4-(cyclopropylsulfamoyl)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide
CID 24618223
4-(cyclopropylsulfamoyl)-N-[(4-fluorophenyl)methyl]benzamide
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CID 27887946
4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide
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3-bromo-4-chloro-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide
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N-(4-acetamidophenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 30683390

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide?
The IUPAC name of 4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide (CID 70769591) is 4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide.
What is the SMILES notation for 4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide?
The canonical SMILES for 4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide is O=C(NCC1(CO)CCOCC1)c1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of 4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide?
The InChIKey is ZULSKQJEFRCLMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O5S/c20-12-17(7-9-24-10-8-17)11-18-16(21)13-1-5-15(6-2-13)25(22,23)19-14-3-4-14/h1-2,5-6,14,19-20H,3-4,7-12H2,(H,18,21).
What are the key properties of 4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide?
4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide has a molecular weight of 368.46 g/mol, XLogP of 0.65, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylsulfamoyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]benzamide is sourced from PubChem (CID 70769591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).