N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine

C15H21N3O2S — CID 133362074

IUPACN-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine
SMILESO=S(=O)(c1ccc(NC2CC=CC2)nc1)N1CCCCC1
InChIInChI=1S/C15H21N3O2S/c19-21(20,18-10-4-1-5-11-18)14-8-9-15(16-12-14)17-13-6-2-3-7-13/h2-3,8-9,12-13H,1,4-7,10-11H2,(H,16,17)
InChIKeyOQLUPYIKOZKDNQ-UHFFFAOYSA-N
MW307.42 g/mol
LogP2.39
Rot. Bonds4

About N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine

N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine (PubChem CID 133362074) has the molecular formula C15H21N3O2S and a molecular weight of 307.42 g/mol. Its IUPAC name is N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine.

Molecular Properties

Compound NameN-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine
PubChem CID133362074
Molecular FormulaC15H21N3O2S
Molecular Weight307.42 g/mol
Exact Mass307.14
IUPAC NameN-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine
SMILESO=S(=O)(c1ccc(NC2CC=CC2)nc1)N1CCCCC1
InChIInChI=1S/C15H21N3O2S/c19-21(20,18-10-4-1-5-11-18)14-8-9-15(16-12-14)17-13-6-2-3-7-13/h2-3,8-9,12-13H,1,4-7,10-11H2,(H,16,17)
InChIKeyOQLUPYIKOZKDNQ-UHFFFAOYSA-N
XLogP2.39
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.42
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 133322670
2-[4-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]piperidin-1-yl]cyclohexan-1-ol
CID 133376514
5-piperidin-1-ylsulfonyl-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridin-2-amine
CID 127767110
6-(cyclopent-3-en-1-ylamino)-N-methylpyridine-3-sulfonamide
CID 133362208
N-propan-2-yl-5-pyrrolidin-1-ylsulfonylpyridin-2-amine
CID 5268153
N-(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 133281602
N-[1-(oxolan-3-ylmethyl)piperidin-4-yl]-5-piperidin-1-ylsulfonylpyridin-2-amine
CID 133305299
1-phenyl-2-(5-piperidin-1-ylsulfonyl-2-pyridinyl)hydrazine
CID 5267961
5-piperidin-1-ylsulfonyl-N-prop-2-ynylpyridin-2-amine
CID 9251897
2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide
CID 8567255
N-(2-cyclopentylethyl)-5-piperidin-1-ylsulfonylpyridin-2-amine
CID 55566148
N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide
CID 31580113

Frequently Asked Questions

What is the IUPAC name of N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine?
The IUPAC name of N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine (CID 133362074) is N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine.
What is the SMILES notation for N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine?
The canonical SMILES for N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine is O=S(=O)(c1ccc(NC2CC=CC2)nc1)N1CCCCC1.
What is the InChIKey of N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine?
The InChIKey is OQLUPYIKOZKDNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2S/c19-21(20,18-10-4-1-5-11-18)14-8-9-15(16-12-14)17-13-6-2-3-7-13/h2-3,8-9,12-13H,1,4-7,10-11H2,(H,16,17).
What are the key properties of N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine?
N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine has a molecular weight of 307.42 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine is sourced from PubChem (CID 133362074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).