3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide

C11H18N4O3S — CID 91830837

IUPAC3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide
SMILESCS(=O)(=O)NCCC(=O)NCc1n[nH]c2c1CCC2
InChIInChI=1S/C11H18N4O3S/c1-19(17,18)13-6-5-11(16)12-7-10-8-3-2-4-9(8)14-15-10/h13H,2-7H2,1H3,(H,12,16)(H,14,15)
InChIKeyIBISBMQMWLHLBD-UHFFFAOYSA-N
MW286.36 g/mol
LogP-0.55
Rot. Bonds6

About 3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide

3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide (PubChem CID 91830837) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is 3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide
PubChem CID91830837
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC Name3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide
SMILESCS(=O)(=O)NCCC(=O)NCc1n[nH]c2c1CCC2
InChIInChI=1S/C11H18N4O3S/c1-19(17,18)13-6-5-11(16)12-7-10-8-3-2-4-9(8)14-15-10/h13H,2-7H2,1H3,(H,12,16)(H,14,15)
InChIKeyIBISBMQMWLHLBD-UHFFFAOYSA-N
XLogP-0.55
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 5-0.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide?
The IUPAC name of 3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide (CID 91830837) is 3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide.
What is the SMILES notation for 3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide?
The canonical SMILES for 3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide is CS(=O)(=O)NCCC(=O)NCc1n[nH]c2c1CCC2.
What is the InChIKey of 3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide?
The InChIKey is IBISBMQMWLHLBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-19(17,18)13-6-5-11(16)12-7-10-8-3-2-4-9(8)14-15-10/h13H,2-7H2,1H3,(H,12,16)(H,14,15).
What are the key properties of 3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide?
3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide has a molecular weight of 286.36 g/mol, XLogP of -0.55, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methanesulfonamido)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propanamide is sourced from PubChem (CID 91830837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).