3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide

C21H25N3O6S2 — CID 24680805

IUPAC3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide
SMILESO=C(NCc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C21H25N3O6S2/c25-21(16-5-3-6-19(14-16)31(26,27)23-18-8-9-18)22-15-17-4-1-2-7-20(17)32(28,29)24-10-12-30-13-11-24/h1-7,14,18,23H,8-13,15H2,(H,22,25)
InChIKeyZZTLNZSPPRSSDP-UHFFFAOYSA-N
MW479.58 g/mol
LogP1.08
Rot. Bonds8

About 3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide

3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide (PubChem CID 24680805) has the molecular formula C21H25N3O6S2 and a molecular weight of 479.58 g/mol. Its IUPAC name is 3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide.

Molecular Properties

Compound Name3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide
PubChem CID24680805
Molecular FormulaC21H25N3O6S2
Molecular Weight479.58 g/mol
Exact Mass479.12
IUPAC Name3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide
SMILESO=C(NCc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C21H25N3O6S2/c25-21(16-5-3-6-19(14-16)31(26,27)23-18-8-9-18)22-15-17-4-1-2-7-20(17)32(28,29)24-10-12-30-13-11-24/h1-7,14,18,23H,8-13,15H2,(H,22,25)
InChIKeyZZTLNZSPPRSSDP-UHFFFAOYSA-N
XLogP1.08
TPSA121.88 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500479.58
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-chloro-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-4-carboxamide
CID 33308662
3-(cyclopentylsulfamoyl)-N-[(2-methylphenyl)methyl]benzamide
CID 109063155
N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-phenyl-2,1-benzoxazole-5-carboxamide
CID 24584059
3-(cyclopropylsulfamoyl)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide
CID 55642118
6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide
CID 18149126
3-(cyclopentylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide
CID 46581452
3-morpholin-4-ylsulfonyl-N-(naphthalen-2-ylmethyl)benzamide
CID 94042950
N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-1-benzofuran-2-carboxamide
CID 17442191
2-[(3-morpholin-4-ylsulfonylbenzoyl)amino]acetic acid
CID 24691198
N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 18167940
3-(cyclopentylsulfamoyl)-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide
CID 46588506
3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide
CID 2963679

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide?
The IUPAC name of 3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide (CID 24680805) is 3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide.
What is the SMILES notation for 3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide?
The canonical SMILES for 3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide is O=C(NCc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(S(=O)(=O)NC2CC2)c1.
What is the InChIKey of 3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide?
The InChIKey is ZZTLNZSPPRSSDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O6S2/c25-21(16-5-3-6-19(14-16)31(26,27)23-18-8-9-18)22-15-17-4-1-2-7-20(17)32(28,29)24-10-12-30-13-11-24/h1-7,14,18,23H,8-13,15H2,(H,22,25).
What are the key properties of 3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide?
3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide has a molecular weight of 479.58 g/mol, XLogP of 1.08, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide is sourced from PubChem (CID 24680805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).