N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide

C14H24N4O2S — CID 114505908

IUPACN-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)NC2CCN(C)CC2C)ccn1
InChIInChI=1S/C14H24N4O2S/c1-4-15-14-9-12(5-7-16-14)21(19,20)17-13-6-8-18(3)10-11(13)2/h5,7,9,11,13,17H,4,6,8,10H2,1-3H3,(H,15,16)
InChIKeyZVPZZRBOYPOJOF-UHFFFAOYSA-N
MW312.44 g/mol
LogP1.13
Rot. Bonds5

About N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide

N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide (PubChem CID 114505908) has the molecular formula C14H24N4O2S and a molecular weight of 312.44 g/mol. Its IUPAC name is N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide.

Molecular Properties

Compound NameN-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide
PubChem CID114505908
Molecular FormulaC14H24N4O2S
Molecular Weight312.44 g/mol
Exact Mass312.16
IUPAC NameN-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)NC2CCN(C)CC2C)ccn1
InChIInChI=1S/C14H24N4O2S/c1-4-15-14-9-12(5-7-16-14)21(19,20)17-13-6-8-18(3)10-11(13)2/h5,7,9,11,13,17H,4,6,8,10H2,1-3H3,(H,15,16)
InChIKeyZVPZZRBOYPOJOF-UHFFFAOYSA-N
XLogP1.13
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-Fluorobenzyl)-N-(2-Methylpropyl)-6-{[1-(Methylsulfonyl)piperidin-4-Yl]amino}pyridine-3-Sulfonamide
CID 86277915
N-(4-Methyl-2-pyridyl)benzenesulfonamide
CID 739341
N-cyclohexyl-6-morpholino-3-pyridinesulfonamide
CID 2738739
1-Ethyl-4-(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)piperazine
CID 4877436
N-ethyl-5-piperidin-1-ylsulfonylpyridin-2-amine
CID 5267927
6-[(2S)-4-[(6-amino-3-pyridinyl)sulfonyl]-2-prop-1-ynylpiperazin-1-yl]-N-methylpyridine-3-sulfonamide
CID 73332275
3-Methyl-4H-pyrido(2,3-e)-1,2,4-thiadiazine 1,1-
CID 116790
2H-Pyrido(2,3-e)-1,2,4-thiadiazine, 1,1-dioxide
CID 3054012
6-(benzylamino)-N,N-diethyl-3-pyridinesulfonamide
CID 829837
N,N-diisopropyl-6-(propylamino)-3-pyridinesulfonamide
CID 1741689
N,N-diethyl-6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-sulfonamide
CID 4879849
N,N-diethyl-6-(pyridin-2-ylmethylamino)pyridine-3-sulfonamide
CID 4799617

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide?
The IUPAC name of N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide (CID 114505908) is N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide.
What is the SMILES notation for N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide?
The canonical SMILES for N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide is CCNc1cc(S(=O)(=O)NC2CCN(C)CC2C)ccn1.
What is the InChIKey of N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide?
The InChIKey is ZVPZZRBOYPOJOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2S/c1-4-15-14-9-12(5-7-16-14)21(19,20)17-13-6-8-18(3)10-11(13)2/h5,7,9,11,13,17H,4,6,8,10H2,1-3H3,(H,15,16).
What are the key properties of N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide?
N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide has a molecular weight of 312.44 g/mol, XLogP of 1.13, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide is sourced from PubChem (CID 114505908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).