4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine

C14H22N4O2S — CID 62152286

IUPAC4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine
SMILESCCNc1cc(S(=O)(=O)N2CCN(C3CC3)CC2)ccn1
InChIInChI=1S/C14H22N4O2S/c1-2-15-14-11-13(5-6-16-14)21(19,20)18-9-7-17(8-10-18)12-3-4-12/h5-6,11-12H,2-4,7-10H2,1H3,(H,15,16)
InChIKeyVEJLTCRDIICHON-UHFFFAOYSA-N
MW310.42 g/mol
LogP0.98
Rot. Bonds5

About 4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine

4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine (PubChem CID 62152286) has the molecular formula C14H22N4O2S and a molecular weight of 310.42 g/mol. Its IUPAC name is 4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine
PubChem CID62152286
Molecular FormulaC14H22N4O2S
Molecular Weight310.42 g/mol
Exact Mass310.15
IUPAC Name4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine
SMILESCCNc1cc(S(=O)(=O)N2CCN(C3CC3)CC2)ccn1
InChIInChI=1S/C14H22N4O2S/c1-2-15-14-11-13(5-6-16-14)21(19,20)18-9-7-17(8-10-18)12-3-4-12/h5-6,11-12H,2-4,7-10H2,1H3,(H,15,16)
InChIKeyVEJLTCRDIICHON-UHFFFAOYSA-N
XLogP0.98
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylsulfonyl)-N-ethylpyridin-2-amine
CID 79933811
N-ethyl-4-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine
CID 55043507
1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]pyrrolidin-3-ol
CID 62942337
N-ethyl-4-(3-methoxypyrrolidin-1-yl)sulfonylpyridin-2-amine
CID 103538318
4-(4-benzylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine
CID 113228640
N-ethyl-4-(1,4-thiazepan-4-ylsulfonyl)pyridin-2-amine
CID 62152799
[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]-3-methylpyrrolidin-2-yl]methanol
CID 102789194
[1-[[2-(propylamino)-4-pyridinyl]sulfonyl]piperidin-4-yl]methanol
CID 62164530
2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol
CID 62144222
N-methyl-4-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 62148755
2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide
CID 63275008
1-[[2-(propylamino)-4-pyridinyl]sulfonyl]piperidin-3-ol
CID 62153093

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine?
The IUPAC name of 4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine (CID 62152286) is 4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine.
What is the SMILES notation for 4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine?
The canonical SMILES for 4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine is CCNc1cc(S(=O)(=O)N2CCN(C3CC3)CC2)ccn1.
What is the InChIKey of 4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine?
The InChIKey is VEJLTCRDIICHON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2S/c1-2-15-14-11-13(5-6-16-14)21(19,20)18-9-7-17(8-10-18)12-3-4-12/h5-6,11-12H,2-4,7-10H2,1H3,(H,15,16).
What are the key properties of 4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine?
4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine has a molecular weight of 310.42 g/mol, XLogP of 0.98, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine is sourced from PubChem (CID 62152286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).