N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide

C14H18N4O2S — CID 119987043

IUPACN-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide
SMILESNCC(NS(=O)(=O)c1cnn(-c2ccccc2)c1)C1CC1
InChIInChI=1S/C14H18N4O2S/c15-8-14(11-6-7-11)17-21(19,20)13-9-16-18(10-13)12-4-2-1-3-5-12/h1-5,9-11,14,17H,6-8,15H2
InChIKeyHJYIWCXSHDQPMC-UHFFFAOYSA-N
MW306.39 g/mol
LogP0.89
Rot. Bonds6

About N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide

N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide (PubChem CID 119987043) has the molecular formula C14H18N4O2S and a molecular weight of 306.39 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide
PubChem CID119987043
Molecular FormulaC14H18N4O2S
Molecular Weight306.39 g/mol
Exact Mass306.12
IUPAC NameN-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide
SMILESNCC(NS(=O)(=O)c1cnn(-c2ccccc2)c1)C1CC1
InChIInChI=1S/C14H18N4O2S/c15-8-14(11-6-7-11)17-21(19,20)13-9-16-18(10-13)12-4-2-1-3-5-12/h1-5,9-11,14,17H,6-8,15H2
InChIKeyHJYIWCXSHDQPMC-UHFFFAOYSA-N
XLogP0.89
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-amino-1-cyclohexylethyl)-1-(2-fluorophenyl)pyrazole-4-sulfonamide
CID 119983754
N-(2-amino-1-cyclohexylethyl)-1-(2-fluorophenyl)pyrazole-4-sulfonamide;hydrochloride
CID 119983753
N-(2-amino-1-cyclopentylethyl)-1-(2-methoxyphenyl)pyrazole-4-sulfonamide;hydrochloride
CID 120585040
N-(2-amino-1-cyclopropylethyl)-1-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide;hydrochloride
CID 120711275
N-[2-(aminomethyl)cyclohexyl]-1-phenylpyrazole-4-sulfonamide
CID 119986497
N-cyclopentyl-1-phenylpyrazole-4-sulfonamide
CID 47439844
N-(2-amino-1-cyclopentylethyl)-1-(oxan-4-yl)pyrazole-4-sulfonamide
CID 120584893
1-phenyl-N-[(2S)-1-(1,2,4-triazol-1-yl)propan-2-yl]pyrazole-4-sulfonamide
CID 95316681
N-(2-amino-1-cyclohexylethyl)-2-phenylpyrimidine-5-sulfonamide;hydrochloride
CID 120710800
N-(2-amino-1-cyclopropylethyl)-4-tert-butylbenzenesulfonamide
CID 65188828
4-N-(2-amino-1-cyclopropylethyl)-1-N-cyclopropylbenzene-1,4-disulfonamide
CID 119986909
1-phenyl-N-[(1R,2R)-2-phenylcyclopropyl]pyrazole-4-sulfonamide
CID 95259394

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide (CID 119987043) is N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide is NCC(NS(=O)(=O)c1cnn(-c2ccccc2)c1)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide?
The InChIKey is HJYIWCXSHDQPMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2S/c15-8-14(11-6-7-11)17-21(19,20)13-9-16-18(10-13)12-4-2-1-3-5-12/h1-5,9-11,14,17H,6-8,15H2.
What are the key properties of N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide?
N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide has a molecular weight of 306.39 g/mol, XLogP of 0.89, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-4-sulfonamide is sourced from PubChem (CID 119987043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).