4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine

C7H15N5O2S — CID 114811090

IUPAC4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine
SMILESCCCNS(=O)(=O)NCc1cn[nH]c1N
InChIInChI=1S/C7H15N5O2S/c1-2-3-10-15(13,14)11-5-6-4-9-12-7(6)8/h4,10-11H,2-3,5H2,1H3,(H3,8,9,12)
InChIKeyOVFGJXGUNKCLPX-UHFFFAOYSA-N
MW233.30 g/mol
LogP-0.67
Rot. Bonds6

About 4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine

4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine (PubChem CID 114811090) has the molecular formula C7H15N5O2S and a molecular weight of 233.30 g/mol. Its IUPAC name is 4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine
PubChem CID114811090
Molecular FormulaC7H15N5O2S
Molecular Weight233.30 g/mol
Exact Mass233.09
IUPAC Name4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine
SMILESCCCNS(=O)(=O)NCc1cn[nH]c1N
InChIInChI=1S/C7H15N5O2S/c1-2-3-10-15(13,14)11-5-6-4-9-12-7(6)8/h4,10-11H,2-3,5H2,1H3,(H3,8,9,12)
InChIKeyOVFGJXGUNKCLPX-UHFFFAOYSA-N
XLogP-0.67
TPSA112.90 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 5-0.67
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine?
The IUPAC name of 4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine (CID 114811090) is 4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine.
What is the SMILES notation for 4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine?
The canonical SMILES for 4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine is CCCNS(=O)(=O)NCc1cn[nH]c1N.
What is the InChIKey of 4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine?
The InChIKey is OVFGJXGUNKCLPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N5O2S/c1-2-3-10-15(13,14)11-5-6-4-9-12-7(6)8/h4,10-11H,2-3,5H2,1H3,(H3,8,9,12).
What are the key properties of 4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine?
4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine has a molecular weight of 233.30 g/mol, XLogP of -0.67, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(propylsulfamoylamino)methyl]-1H-pyrazol-5-amine is sourced from PubChem (CID 114811090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).