4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine

C13H20N4O2S — CID 62152115

IUPAC4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine
SMILESNc1cc(S(=O)(=O)N2CCN(CC3CC3)CC2)ccn1
InChIInChI=1S/C13H20N4O2S/c14-13-9-12(3-4-15-13)20(18,19)17-7-5-16(6-8-17)10-11-1-2-11/h3-4,9,11H,1-2,5-8,10H2,(H2,14,15)
InChIKeyYPYOLQNTWYXVRZ-UHFFFAOYSA-N
MW296.40 g/mol
LogP0.38
Rot. Bonds4

About 4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine

4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine (PubChem CID 62152115) has the molecular formula C13H20N4O2S and a molecular weight of 296.40 g/mol. Its IUPAC name is 4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine.

Molecular Properties

Compound Name4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine
PubChem CID62152115
Molecular FormulaC13H20N4O2S
Molecular Weight296.40 g/mol
Exact Mass296.13
IUPAC Name4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine
SMILESNc1cc(S(=O)(=O)N2CCN(CC3CC3)CC2)ccn1
InChIInChI=1S/C13H20N4O2S/c14-13-9-12(3-4-15-13)20(18,19)17-7-5-16(6-8-17)10-11-1-2-11/h3-4,9,11H,1-2,5-8,10H2,(H2,14,15)
InChIKeyYPYOLQNTWYXVRZ-UHFFFAOYSA-N
XLogP0.38
TPSA79.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.40
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine 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-(4-propylpiperidin-1-yl)sulfonylpyridin-2-amine
CID 62206687
4-[4-[(dimethylamino)methyl]piperidin-1-yl]sulfonylpyridin-2-amine
CID 62156937
1-(cyclopropylmethyl)-4-(3-methylphenyl)sulfonylpiperazine
CID 110708713
4-thiomorpholin-4-ylsulfonylpyridin-2-amine
CID 62145270
4-(3-propylpyrrolidin-1-yl)sulfonylpyridin-2-amine
CID 113418711
2-[1-[(2-amino-4-pyridinyl)sulfonyl]piperidin-3-yl]ethanol
CID 107228635
4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonyl-3-methylaniline
CID 61116607
4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylthiophene-2-carboxylic acid
CID 61063212
4-bromo-2-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylaniline
CID 61114909
4-(4-ethyl-3-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 63605128
4-(3-ethyl-4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 63603562
1-(3,4-dichlorophenyl)sulfonyl-4-(piperidin-4-ylmethyl)piperazine;hydrochloride
CID 119929370

Frequently Asked Questions

What is the IUPAC name of 4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine?
The IUPAC name of 4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine (CID 62152115) is 4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine.
What is the SMILES notation for 4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine?
The canonical SMILES for 4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine is Nc1cc(S(=O)(=O)N2CCN(CC3CC3)CC2)ccn1.
What is the InChIKey of 4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine?
The InChIKey is YPYOLQNTWYXVRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2S/c14-13-9-12(3-4-15-13)20(18,19)17-7-5-16(6-8-17)10-11-1-2-11/h3-4,9,11H,1-2,5-8,10H2,(H2,14,15).
What are the key properties of 4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine?
4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine has a molecular weight of 296.40 g/mol, XLogP of 0.38, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine is sourced from PubChem (CID 62152115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).