2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide

C16H23N3O3S — CID 119797391

IUPAC2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide
SMILESCc1ccc(NC(=O)CNCC2CC2)cc1S(=O)(=O)NC1CC1
InChIInChI=1S/C16H23N3O3S/c1-11-2-5-14(18-16(20)10-17-9-12-3-4-12)8-15(11)23(21,22)19-13-6-7-13/h2,5,8,12-13,17,19H,3-4,6-7,9-10H2,1H3,(H,18,20)
InChIKeyVSPXSLOQVHDWJP-UHFFFAOYSA-N
MW337.45 g/mol
LogP1.37
Rot. Bonds8

About 2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide

2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide (PubChem CID 119797391) has the molecular formula C16H23N3O3S and a molecular weight of 337.45 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide
PubChem CID119797391
Molecular FormulaC16H23N3O3S
Molecular Weight337.45 g/mol
Exact Mass337.15
IUPAC Name2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide
SMILESCc1ccc(NC(=O)CNCC2CC2)cc1S(=O)(=O)NC1CC1
InChIInChI=1S/C16H23N3O3S/c1-11-2-5-14(18-16(20)10-17-9-12-3-4-12)8-15(11)23(21,22)19-13-6-7-13/h2,5,8,12-13,17,19H,3-4,6-7,9-10H2,1H3,(H,18,20)
InChIKeyVSPXSLOQVHDWJP-UHFFFAOYSA-N
XLogP1.37
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.45
LogP ≤ 51.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide
CID 119331403
N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]-4-(methylamino)butanamide;hydrochloride
CID 119797372
2-(cyclopropylmethylamino)-N-(3,4-dimethylphenyl)acetamide;hydrochloride
CID 119670640
7-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]heptanamide;hydrochloride
CID 119797366
1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride
CID 119797364
3-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclohexane-1-carboxamide
CID 119797379
2-(cyclopropylmethylamino)-N-[4-(ethylsulfonylamino)-3-methylphenyl]acetamide
CID 119739287
2-(cyclopropylmethylamino)-N-(4-fluoro-3-methylphenyl)acetamide;hydrochloride
CID 119707226
2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide
CID 28566911
(2S,4S)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]-2-methylpiperidine-4-carboxamide
CID 120634945
2-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]-2-(4-methylphenyl)acetamide
CID 120668713
2-(2-methoxyethylamino)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide
CID 78912544

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide (CID 119797391) is 2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide is Cc1ccc(NC(=O)CNCC2CC2)cc1S(=O)(=O)NC1CC1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide?
The InChIKey is VSPXSLOQVHDWJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3S/c1-11-2-5-14(18-16(20)10-17-9-12-3-4-12)8-15(11)23(21,22)19-13-6-7-13/h2,5,8,12-13,17,19H,3-4,6-7,9-10H2,1H3,(H,18,20).
What are the key properties of 2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide?
2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide has a molecular weight of 337.45 g/mol, XLogP of 1.37, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide is sourced from PubChem (CID 119797391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).