3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride

C19H30ClN3O4S — CID 119824864

IUPAC3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
SMILESCCCN(C(=O)c1ccc(OC)c(S(=O)(=O)NC2CC2)c1)C1CCNCC1.Cl
InChIInChI=1S/C19H29N3O4S.ClH/c1-3-12-22(16-8-10-20-11-9-16)19(23)14-4-7-17(26-2)18(13-14)27(24,25)21-15-5-6-15;/h4,7,13,15-16,20-21H,3,5-6,8-12H2,1-2H3;1H
InChIKeyNSABQIJTPLOGMJ-UHFFFAOYSA-N
MW431.99 g/mol
LogP2.16
Rot. Bonds8

About 3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride

3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride (PubChem CID 119824864) has the molecular formula C19H30ClN3O4S and a molecular weight of 431.99 g/mol. Its IUPAC name is 3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride.

Molecular Properties

Compound Name3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
PubChem CID119824864
Molecular FormulaC19H30ClN3O4S
Molecular Weight431.99 g/mol
Exact Mass431.16
IUPAC Name3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
SMILESCCCN(C(=O)c1ccc(OC)c(S(=O)(=O)NC2CC2)c1)C1CCNCC1.Cl
InChIInChI=1S/C19H29N3O4S.ClH/c1-3-12-22(16-8-10-20-11-9-16)19(23)14-4-7-17(26-2)18(13-14)27(24,25)21-15-5-6-15;/h4,7,13,15-16,20-21H,3,5-6,8-12H2,1-2H3;1H
InChIKeyNSABQIJTPLOGMJ-UHFFFAOYSA-N
XLogP2.16
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.99
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823113
4-methoxy-3-nitro-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119825588
2-[[3-(cyclopropylsulfamoyl)-4-methoxybenzoyl]-ethylamino]acetic acid
CID 119205722
N-piperidin-4-yl-3,4-dipropoxy-N-propylbenzamide
CID 119825767
[2-oxo-2-(propylamino)ethyl] 3-(cyclopropylsulfamoyl)-4-methoxybenzoate
CID 7519308
3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119825801
3-methoxy-4-propan-2-yloxy-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119532395
3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide
CID 9439194
4-(tert-butylsulfamoyl)-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823590
3-(cyclopropylsulfamoyl)-4-methoxy-N-(2-methylbutan-2-yl)benzamide
CID 46554772
3-(cyclopropylsulfamoyl)-4-methoxy-N-[2-(methylamino)ethyl]benzamide
CID 119502368
3-(cyclopentylsulfamoyl)-4-methoxy-N-pyrrolidin-3-ylbenzamide
CID 119450739

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride?
The IUPAC name of 3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride (CID 119824864) is 3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride.
What is the SMILES notation for 3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride?
The canonical SMILES for 3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride is CCCN(C(=O)c1ccc(OC)c(S(=O)(=O)NC2CC2)c1)C1CCNCC1.Cl.
What is the InChIKey of 3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride?
The InChIKey is NSABQIJTPLOGMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O4S.ClH/c1-3-12-22(16-8-10-20-11-9-16)19(23)14-4-7-17(26-2)18(13-14)27(24,25)21-15-5-6-15;/h4,7,13,15-16,20-21H,3,5-6,8-12H2,1-2H3;1H.
What are the key properties of 3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride?
3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride has a molecular weight of 431.99 g/mol, XLogP of 2.16, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride is sourced from PubChem (CID 119824864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).