4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide

C15H22N2O2S — CID 43682546

IUPAC4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(NC(C2CC2)C2CC2)cc1
InChIInChI=1S/C15H22N2O2S/c1-17(2)20(18,19)14-9-7-13(8-10-14)16-15(11-3-4-11)12-5-6-12/h7-12,15-16H,3-6H2,1-2H3
InChIKeyYUDNQMMVUKCMIW-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.54
Rot. Bonds6

About 4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide

4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide (PubChem CID 43682546) has the molecular formula C15H22N2O2S and a molecular weight of 294.42 g/mol. Its IUPAC name is 4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide.

Molecular Properties

Compound Name4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide
PubChem CID43682546
Molecular FormulaC15H22N2O2S
Molecular Weight294.42 g/mol
Exact Mass294.14
IUPAC Name4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(NC(C2CC2)C2CC2)cc1
InChIInChI=1S/C15H22N2O2S/c1-17(2)20(18,19)14-9-7-13(8-10-14)16-15(11-3-4-11)12-5-6-12/h7-12,15-16H,3-6H2,1-2H3
InChIKeyYUDNQMMVUKCMIW-UHFFFAOYSA-N
XLogP2.54
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-2-[4-(dimethylsulfamoyl)anilino]acetic acid
CID 62696169
4-(dicyclopropylmethylamino)-N-methylbenzenesulfonamide
CID 43742541
4-amino-3-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide
CID 82898396
N,N-dimethyl-4-[1-(1-methylcyclopropyl)ethylamino]benzenesulfonamide
CID 43682540
N,N-dimethyl-4-(methylamino)benzenesulfonamide;hydrochloride
CID 86775481
N-(dicyclopropylmethyl)-4-nitroaniline
CID 43425665
2-[4-(dimethylsulfamoyl)anilino]-3-methylbutanamide
CID 106345924
3-[4-(dimethylsulfamoyl)anilino]butanoic acid
CID 43453879
4-[(1-chloro-4-methylpentan-2-yl)amino]-N,N-dimethylbenzenesulfonamide
CID 65029603
4-[(2-aminocyclopropyl)amino]-N,N-dimethylbenzenesulfonamide
CID 43598794
4-(ethylamino)-N,N-dimethylbenzenesulfonamide
CID 43415076
4-(heptan-2-ylamino)-N,N-dimethylbenzenesulfonamide
CID 43682515

Frequently Asked Questions

What is the IUPAC name of 4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide?
The IUPAC name of 4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide (CID 43682546) is 4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide.
What is the SMILES notation for 4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide?
The canonical SMILES for 4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide is CN(C)S(=O)(=O)c1ccc(NC(C2CC2)C2CC2)cc1.
What is the InChIKey of 4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide?
The InChIKey is YUDNQMMVUKCMIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2S/c1-17(2)20(18,19)14-9-7-13(8-10-14)16-15(11-3-4-11)12-5-6-12/h7-12,15-16H,3-6H2,1-2H3.
What are the key properties of 4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide?
4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide has a molecular weight of 294.42 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dicyclopropylmethylamino)-N,N-dimethylbenzenesulfonamide is sourced from PubChem (CID 43682546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).