1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine

C15H24N4O2S — CID 902073

IUPAC1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine
SMILESCN1CCN(c2ccncc2S(=O)(=O)N2CCCCC2)CC1
InChIInChI=1S/C15H24N4O2S/c1-17-9-11-18(12-10-17)14-5-6-16-13-15(14)22(20,21)19-7-3-2-4-8-19/h5-6,13H,2-4,7-12H2,1H3
InChIKeyAWFFSMIFQFAWIB-UHFFFAOYSA-N
MW324.45 g/mol
LogP1.01
Rot. Bonds3

About 1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine

1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine (PubChem CID 902073) has the molecular formula C15H24N4O2S and a molecular weight of 324.45 g/mol. Its IUPAC name is 1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine.

Molecular Properties

Compound Name1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine
PubChem CID902073
Molecular FormulaC15H24N4O2S
Molecular Weight324.45 g/mol
Exact Mass324.16
IUPAC Name1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine
SMILESCN1CCN(c2ccncc2S(=O)(=O)N2CCCCC2)CC1
InChIInChI=1S/C15H24N4O2S/c1-17-9-11-18(12-10-17)14-5-6-16-13-15(14)22(20,21)19-7-3-2-4-8-19/h5-6,13H,2-4,7-12H2,1H3
InChIKeyAWFFSMIFQFAWIB-UHFFFAOYSA-N
XLogP1.01
TPSA56.75 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(pyridin-4-yl)benzenesulfonamide
CID 669138
N,N-bis(pyridin-2-ylmethyl)benzenesulfonamide
CID 2738468
3-(Piperidin-1-ylsulphonyl)pyridine
CID 3623948
4-(Allylamino)-3-pyridinesulfonamide
CID 25044690
4-(5-Methyl-2-pirazolino)-3-pyridinesulfonamide
CID 46704077
4-Ethyl-3,4-dihydro-2H-pyrido[4,3-e][1,2,4]thiadiazine 1,1-dioxide
CID 10608635
N-isopropyl-4-[3-(1-piperidinylsulfonyl)-4-pyridinyl]-1-piperazinecarboxamide
CID 1214480
N-{4-[3-(1-piperidinylsulfonyl)-4-pyridinyl]-1-piperazinyl}propanamide
CID 1214521
N-methyl-4-[4-(3-methylphenyl)-1-piperazinyl]-3-pyridinesulfonamide
CID 901951
4-[4-(3-chlorophenyl)-1-piperazinyl]-N,N-diethyl-3-pyridinesulfonamide
CID 1214515
AJ-333/09219002
CID 4118683
(4-Pyridin-4-ylpiperazin-1-yl)-(1-pyridin-3-ylsulfonylazetidin-3-yl)methanone
CID 62705315

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine?
The IUPAC name of 1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine (CID 902073) is 1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine.
What is the SMILES notation for 1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine?
The canonical SMILES for 1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine is CN1CCN(c2ccncc2S(=O)(=O)N2CCCCC2)CC1.
What is the InChIKey of 1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine?
The InChIKey is AWFFSMIFQFAWIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2S/c1-17-9-11-18(12-10-17)14-5-6-16-13-15(14)22(20,21)19-7-3-2-4-8-19/h5-6,13H,2-4,7-12H2,1H3.
What are the key properties of 1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine?
1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine has a molecular weight of 324.45 g/mol, XLogP of 1.01, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(3-piperidin-1-ylsulfonyl-4-pyridinyl)piperazine is sourced from PubChem (CID 902073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).