4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide

C14H24N4O2S — CID 106070970

IUPAC4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide
SMILESCC1(C)CCCC1NS(=O)(=O)c1[nH]ncc1CNC1CC1
InChIInChI=1S/C14H24N4O2S/c1-14(2)7-3-4-12(14)18-21(19,20)13-10(9-16-17-13)8-15-11-5-6-11/h9,11-12,15,18H,3-8H2,1-2H3,(H,16,17)
InChIKeyDBGLTNBVEDAQIC-UHFFFAOYSA-N
MW312.44 g/mol
LogP1.52
Rot. Bonds6

About 4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide

4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide (PubChem CID 106070970) has the molecular formula C14H24N4O2S and a molecular weight of 312.44 g/mol. Its IUPAC name is 4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound Name4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide
PubChem CID106070970
Molecular FormulaC14H24N4O2S
Molecular Weight312.44 g/mol
Exact Mass312.16
IUPAC Name4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide
SMILESCC1(C)CCCC1NS(=O)(=O)c1[nH]ncc1CNC1CC1
InChIInChI=1S/C14H24N4O2S/c1-14(2)7-3-4-12(14)18-21(19,20)13-10(9-16-17-13)8-15-11-5-6-11/h9,11-12,15,18H,3-8H2,1-2H3,(H,16,17)
InChIKeyDBGLTNBVEDAQIC-UHFFFAOYSA-N
XLogP1.52
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 51.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-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

4-[(cyclopropylamino)methyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65773767
N-cyclopropyl-4-(ethylaminomethyl)-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65784240
4-[(cyclopropylamino)methyl]-N-ethyl-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65784595
4-[(cyclopropylamino)methyl]-N-methyl-N-(3,3,3-trifluoropropyl)-1H-pyrazole-5-sulfonamide
CID 65824159
4-[(cyclopropylamino)methyl]-N-(4,4,4-trifluorobutan-2-yl)-1H-pyrazole-5-sulfonamide
CID 105946719
4-[(propan-2-ylamino)methyl]-N-[1-(trifluoromethyl)cyclopropyl]-1H-pyrazole-5-sulfonamide
CID 106218696
4-[(cyclopropylamino)methyl]-N-(4,4,4-trifluorobutyl)-1H-pyrazole-5-sulfonamide
CID 115522772
4-[(propan-2-ylamino)methyl]-N-(4,4,4-trifluorobutyl)-1H-pyrazole-5-sulfonamide
CID 115522804
4-(ethylaminomethyl)-N-(5,5,5-trifluoropentyl)-1H-pyrazole-5-sulfonamide
CID 115522891
4-[(cyclopropylamino)methyl]-N-(2,2-difluoroethyl)-N-methyl-1H-pyrazole-5-sulfonamide
CID 116318959
N-[[5-(4-methylpiperidin-1-yl)sulfonyl-1H-pyrazol-4-yl]methyl]propan-1-amine
CID 65732091
N-[(5-pyrrolidin-1-ylsulfonyl-1H-pyrazol-4-yl)methyl]cyclopropanamine
CID 65732094

Frequently Asked Questions

What is the IUPAC name of 4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide?
The IUPAC name of 4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide (CID 106070970) is 4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for 4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide?
The canonical SMILES for 4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide is CC1(C)CCCC1NS(=O)(=O)c1[nH]ncc1CNC1CC1.
What is the InChIKey of 4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide?
The InChIKey is DBGLTNBVEDAQIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2S/c1-14(2)7-3-4-12(14)18-21(19,20)13-10(9-16-17-13)8-15-11-5-6-11/h9,11-12,15,18H,3-8H2,1-2H3,(H,16,17).
What are the key properties of 4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide?
4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide has a molecular weight of 312.44 g/mol, XLogP of 1.52, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(cyclopropylamino)methyl]-N-(2,2-dimethylcyclopentyl)-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 106070970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).