1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride

C14H20ClN3O3S — CID 119797364

IUPAC1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)C2(N)CC2)cc1S(=O)(=O)NC1CC1.Cl
InChIInChI=1S/C14H19N3O3S.ClH/c1-9-2-3-11(16-13(18)14(15)6-7-14)8-12(9)21(19,20)17-10-4-5-10;/h2-3,8,10,17H,4-7,15H2,1H3,(H,16,18);1H
InChIKeyDSSGNQSLUITCEC-UHFFFAOYSA-N
MW345.85 g/mol
LogP1.29
Rot. Bonds5

About 1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride

1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride (PubChem CID 119797364) has the molecular formula C14H20ClN3O3S and a molecular weight of 345.85 g/mol. Its IUPAC name is 1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride
PubChem CID119797364
Molecular FormulaC14H20ClN3O3S
Molecular Weight345.85 g/mol
Exact Mass345.09
IUPAC Name1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)C2(N)CC2)cc1S(=O)(=O)NC1CC1.Cl
InChIInChI=1S/C14H19N3O3S.ClH/c1-9-2-3-11(16-13(18)14(15)6-7-14)8-12(9)21(19,20)17-10-4-5-10;/h2-3,8,10,17H,4-7,15H2,1H3,(H,16,18);1H
InChIKeyDSSGNQSLUITCEC-UHFFFAOYSA-N
XLogP1.29
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.85
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-[3-(cyclopropylsulfamoyl)-4-methoxyphenyl]cyclopropane-1-carboxamide
CID 119797467
1-amino-N-[3-(cyclopropylsulfamoyl)-4-fluorophenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119331454
2-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide
CID 119331403
1-amino-N-[3-(cyclopropylsulfamoyl)-4-methoxyphenyl]cyclohexane-1-carboxamide
CID 119331491
N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]-4-(methylamino)butanamide;hydrochloride
CID 119797372
7-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]heptanamide;hydrochloride
CID 119797366
3-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119797376
2-(cyclopropylmethylamino)-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide
CID 119797391
2-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]-2-(4-methylphenyl)acetamide
CID 120668713
1-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]cyclopentane-1-carboxamide
CID 119263744
1-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]cyclobutane-1-carboxamide
CID 81171897
3-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclohexane-1-carboxamide
CID 119797379

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride (CID 119797364) is 1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride is Cc1ccc(NC(=O)C2(N)CC2)cc1S(=O)(=O)NC1CC1.Cl.
What is the InChIKey of 1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride?
The InChIKey is DSSGNQSLUITCEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3S.ClH/c1-9-2-3-11(16-13(18)14(15)6-7-14)8-12(9)21(19,20)17-10-4-5-10;/h2-3,8,10,17H,4-7,15H2,1H3,(H,16,18);1H.
What are the key properties of 1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride?
1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride has a molecular weight of 345.85 g/mol, XLogP of 1.29, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119797364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).