2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide

C13H19N3O3S — CID 60866226

IUPAC2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide
SMILESCc1ccc(S(N)(=O)=O)cc1NC(=O)CNCC1CC1
InChIInChI=1S/C13H19N3O3S/c1-9-2-5-11(20(14,18)19)6-12(9)16-13(17)8-15-7-10-3-4-10/h2,5-6,10,15H,3-4,7-8H2,1H3,(H,16,17)(H2,14,18,19)
InChIKeyIEMQRVXJMXGEPF-UHFFFAOYSA-N
MW297.38 g/mol
LogP0.58
Rot. Bonds6

About 2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide

2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide (PubChem CID 60866226) has the molecular formula C13H19N3O3S and a molecular weight of 297.38 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide
PubChem CID60866226
Molecular FormulaC13H19N3O3S
Molecular Weight297.38 g/mol
Exact Mass297.11
IUPAC Name2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide
SMILESCc1ccc(S(N)(=O)=O)cc1NC(=O)CNCC1CC1
InChIInChI=1S/C13H19N3O3S/c1-9-2-5-11(20(14,18)19)6-12(9)16-13(17)8-15-7-10-3-4-10/h2,5-6,10,15H,3-4,7-8H2,1H3,(H,16,17)(H2,14,18,19)
InChIKeyIEMQRVXJMXGEPF-UHFFFAOYSA-N
XLogP0.58
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 50.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-5-sulfamoylphenyl)-2-(oxolan-2-yl)acetamide
CID 65159878
2-cyano-N-(2-methyl-5-sulfamoylphenyl)acetamide
CID 168521039
ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate
CID 61063184
3,3,3-trifluoro-N-(2-methyl-5-sulfamoylphenyl)propanamide
CID 61130873
3-(cyclohexylmethylamino)-4-methylbenzenesulfonamide
CID 43744206
2-cyclobutyl-N-(2-methyl-4-sulfamoylphenyl)acetamide
CID 103164399
2-(1-aminocyclopentyl)-N-(2-methyl-5-sulfamoylphenyl)acetamide
CID 64685240
3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-ethyl-4-methylbenzamide
CID 60867288
3-amino-N-(2-methyl-5-sulfamoylphenyl)cyclopentane-1-carboxamide
CID 66008738
(2-methyl-5-sulfamoylphenyl)thiourea
CID 169356925
5-bromo-N-(2-methyl-5-sulfamoylphenyl)pentanamide
CID 107908940
2-(cyclopropylmethylamino)-N-(2,4-dimethylphenyl)acetamide
CID 54924969

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide (CID 60866226) is 2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide is Cc1ccc(S(N)(=O)=O)cc1NC(=O)CNCC1CC1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide?
The InChIKey is IEMQRVXJMXGEPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3S/c1-9-2-5-11(20(14,18)19)6-12(9)16-13(17)8-15-7-10-3-4-10/h2,5-6,10,15H,3-4,7-8H2,1H3,(H,16,17)(H2,14,18,19).
What are the key properties of 2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide?
2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide has a molecular weight of 297.38 g/mol, XLogP of 0.58, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide is sourced from PubChem (CID 60866226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).