N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide

C14H23N3O2S — CID 86266500

IUPACN-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide
SMILESCn1nc(CN(C2CCCC2)S(C)(=O)=O)cc1C1CC1
InChIInChI=1S/C14H23N3O2S/c1-16-14(11-7-8-11)9-12(15-16)10-17(20(2,18)19)13-5-3-4-6-13/h9,11,13H,3-8,10H2,1-2H3
InChIKeyXOSFIAXMLIOOKD-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.00
Rot. Bonds5

About N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide

N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide (PubChem CID 86266500) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide.

Molecular Properties

Compound NameN-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide
PubChem CID86266500
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC NameN-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide
SMILESCn1nc(CN(C2CCCC2)S(C)(=O)=O)cc1C1CC1
InChIInChI=1S/C14H23N3O2S/c1-16-14(11-7-8-11)9-12(15-16)10-17(20(2,18)19)13-5-3-4-6-13/h9,11,13H,3-8,10H2,1-2H3
InChIKeyXOSFIAXMLIOOKD-UHFFFAOYSA-N
XLogP2.00
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide?
The IUPAC name of N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide (CID 86266500) is N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide.
What is the SMILES notation for N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide?
The canonical SMILES for N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide is Cn1nc(CN(C2CCCC2)S(C)(=O)=O)cc1C1CC1.
What is the InChIKey of N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide?
The InChIKey is XOSFIAXMLIOOKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-16-14(11-7-8-11)9-12(15-16)10-17(20(2,18)19)13-5-3-4-6-13/h9,11,13H,3-8,10H2,1-2H3.
What are the key properties of N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide?
N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.00, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]methanesulfonamide is sourced from PubChem (CID 86266500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).