1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride

C17H26ClN3O3S — CID 119287766

IUPAC1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
SMILESCl.NC1(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)CCCCC1
InChIInChI=1S/C17H25N3O3S.ClH/c18-17(10-2-1-3-11-17)16(21)20-14-6-8-15(9-7-14)24(22,23)19-12-13-4-5-13;/h6-9,13,19H,1-5,10-12,18H2,(H,20,21);1H
InChIKeyGMFIKTUVOIXDSR-UHFFFAOYSA-N
MW387.93 g/mol
LogP2.40
Rot. Bonds6

About 1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride

1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride (PubChem CID 119287766) has the molecular formula C17H26ClN3O3S and a molecular weight of 387.93 g/mol. Its IUPAC name is 1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
PubChem CID119287766
Molecular FormulaC17H26ClN3O3S
Molecular Weight387.93 g/mol
Exact Mass387.14
IUPAC Name1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
SMILESCl.NC1(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)CCCCC1
InChIInChI=1S/C17H25N3O3S.ClH/c18-17(10-2-1-3-11-17)16(21)20-14-6-8-15(9-7-14)24(22,23)19-12-13-4-5-13;/h6-9,13,19H,1-5,10-12,18H2,(H,20,21);1H
InChIKeyGMFIKTUVOIXDSR-UHFFFAOYSA-N
XLogP2.40
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.93
LogP ≤ 52.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 119325257
1-amino-N-[4-(methanesulfonamidomethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119328489
1-amino-N-[4-(methylsulfamoyl)phenyl]cyclobutane-1-carboxamide
CID 81178892
(2S)-N-[4-(cyclopropylmethylsulfamoyl)phenyl]-2-hydroxypropanamide
CID 167949883
1-amino-N-[4-(hydroxymethyl)phenyl]cyclohexane-1-carboxamide
CID 113397756
1-amino-N-(4-fluorophenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119261942
1-amino-N-(4-cyclopentyloxyphenyl)cyclohexane-1-carboxamide
CID 119284690
1-amino-N-[4-(dimethylsulfamoyl)phenyl]cyclopentane-1-carboxamide
CID 60866670
N-[[1-(1-aminocyclohexanecarbonyl)piperidin-3-yl]methyl]-4-methylbenzenesulfonamide;hydrochloride
CID 119314564
N-(cyclobutylmethyl)-4-hydrazinylbenzenesulfonamide
CID 43455189
N-[4-(cyclopropylmethylsulfamoyl)phenyl]piperidine-4-carboxamide
CID 119287751
1-amino-N-[4-(oxan-4-ylmethoxy)phenyl]cyclohexane-1-carboxamide
CID 119329322

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride (CID 119287766) is 1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride is Cl.NC1(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)CCCCC1.
What is the InChIKey of 1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The InChIKey is GMFIKTUVOIXDSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3S.ClH/c18-17(10-2-1-3-11-17)16(21)20-14-6-8-15(9-7-14)24(22,23)19-12-13-4-5-13;/h6-9,13,19H,1-5,10-12,18H2,(H,20,21);1H.
What are the key properties of 1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride has a molecular weight of 387.93 g/mol, XLogP of 2.40, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[4-(cyclopropylmethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119287766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).