N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide

C14H23N3O2S — CID 60890944

IUPACN-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide
SMILESCCN(C1CCNCC1)S(=O)(=O)CCc1ccncc1
InChIInChI=1S/C14H23N3O2S/c1-2-17(14-5-10-16-11-6-14)20(18,19)12-7-13-3-8-15-9-4-13/h3-4,8-9,14,16H,2,5-7,10-12H2,1H3
InChIKeyLJRVZNBTBJEEDW-UHFFFAOYSA-N
MW297.42 g/mol
LogP1.03
Rot. Bonds6

About N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide

N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide (PubChem CID 60890944) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide.

Molecular Properties

Compound NameN-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide
PubChem CID60890944
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC NameN-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide
SMILESCCN(C1CCNCC1)S(=O)(=O)CCc1ccncc1
InChIInChI=1S/C14H23N3O2S/c1-2-17(14-5-10-16-11-6-14)20(18,19)12-7-13-3-8-15-9-4-13/h3-4,8-9,14,16H,2,5-7,10-12H2,1H3
InChIKeyLJRVZNBTBJEEDW-UHFFFAOYSA-N
XLogP1.03
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-piperidin-3-yl-N-propyl-2-pyridin-4-ylethanesulfonamide
CID 60891329
N-methyl-N-piperidin-4-yl-1-pyridin-4-ylmethanesulfonamide
CID 71641545
N-(3-bromopropyl)-N-cyclobutyl-2-pyridin-4-ylethanesulfonamide
CID 102873306
N-(2-bromoethyl)-N-cyclohexyl-2-pyridin-4-ylethanesulfonamide
CID 80668910
N-ethyl-N-(piperidin-3-ylmethyl)-2-pyridin-4-ylethanesulfonamide
CID 106631087
2-ethoxy-N-ethyl-N-piperidin-4-ylethanesulfonamide
CID 63246667
3-[cyclopropyl(2-pyridin-4-ylethylsulfonyl)amino]-N'-hydroxypropanimidamide
CID 76911647
N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]-N-methyl-2-pyridin-4-ylethanesulfonamide
CID 61142839
N-methyl-N-(pyridin-4-ylmethyl)piperidin-4-amine;hydrochloride
CID 71641683
4-(2-ethylsulfonylethyl)pyridine
CID 59155282
N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide
CID 43602089
2-[ethyl(2-pyridin-4-ylethylsulfonyl)amino]acetic acid
CID 54900131

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide?
The IUPAC name of N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide (CID 60890944) is N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide.
What is the SMILES notation for N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide?
The canonical SMILES for N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide is CCN(C1CCNCC1)S(=O)(=O)CCc1ccncc1.
What is the InChIKey of N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide?
The InChIKey is LJRVZNBTBJEEDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-2-17(14-5-10-16-11-6-14)20(18,19)12-7-13-3-8-15-9-4-13/h3-4,8-9,14,16H,2,5-7,10-12H2,1H3.
What are the key properties of N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide?
N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide has a molecular weight of 297.42 g/mol, XLogP of 1.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-piperidin-4-yl-2-pyridin-4-ylethanesulfonamide is sourced from PubChem (CID 60890944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).