N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine

C15H21N3O3S — CID 133322670

IUPACN-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine
SMILESO=S(=O)(c1ccc(NC2CC=CCC2)nc1)N1CCOCC1
InChIInChI=1S/C15H21N3O3S/c19-22(20,18-8-10-21-11-9-18)14-6-7-15(16-12-14)17-13-4-2-1-3-5-13/h1-2,6-7,12-13H,3-5,8-11H2,(H,16,17)
InChIKeyQFMIIXZSAFQZRK-UHFFFAOYSA-N
MW323.42 g/mol
LogP1.62
Rot. Bonds4

About N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine

N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine (PubChem CID 133322670) has the molecular formula C15H21N3O3S and a molecular weight of 323.42 g/mol. Its IUPAC name is N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine.

Molecular Properties

Compound NameN-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine
PubChem CID133322670
Molecular FormulaC15H21N3O3S
Molecular Weight323.42 g/mol
Exact Mass323.13
IUPAC NameN-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine
SMILESO=S(=O)(c1ccc(NC2CC=CCC2)nc1)N1CCOCC1
InChIInChI=1S/C15H21N3O3S/c19-22(20,18-8-10-21-11-9-18)14-6-7-15(16-12-14)17-13-4-2-1-3-5-13/h1-2,6-7,12-13H,3-5,8-11H2,(H,16,17)
InChIKeyQFMIIXZSAFQZRK-UHFFFAOYSA-N
XLogP1.62
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.42
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(1-ethylpiperidin-4-yl)-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 8566045
N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine
CID 133362074
N-(1-benzylpiperidin-3-yl)-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 60503346
N-[(1S,2S)-2-methylcyclohexyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 9311729
6-(cyclohex-3-en-1-ylamino)-N,N-di(propan-2-yl)pyridine-3-sulfonamide
CID 133322671
5-morpholin-4-ylsulfonylpyridine-2-thiolate
CID 7063956
N-(4-methylphenyl)-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 5268105
5-morpholin-4-ylsulfonyl-N-[(1R)-1-phenylethyl]pyridin-2-amine
CID 9211241
3,5-dimethyl-N'-(5-morpholin-4-ylsulfonyl-2-pyridinyl)pyrazolidine-4-sulfonohydrazide
CID 52987336
N-butyl-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 5268046
1-[(1R)-cyclohex-3-en-1-yl]-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]methanamine
CID 41236223
N-[1-(oxolan-3-ylmethyl)piperidin-4-yl]-5-piperidin-1-ylsulfonylpyridin-2-amine
CID 133305299

Frequently Asked Questions

What is the IUPAC name of N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine?
The IUPAC name of N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine (CID 133322670) is N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine.
What is the SMILES notation for N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine?
The canonical SMILES for N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine is O=S(=O)(c1ccc(NC2CC=CCC2)nc1)N1CCOCC1.
What is the InChIKey of N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine?
The InChIKey is QFMIIXZSAFQZRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3S/c19-22(20,18-8-10-21-11-9-18)14-6-7-15(16-12-14)17-13-4-2-1-3-5-13/h1-2,6-7,12-13H,3-5,8-11H2,(H,16,17).
What are the key properties of N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine?
N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine has a molecular weight of 323.42 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohex-3-en-1-yl-5-morpholin-4-ylsulfonylpyridin-2-amine is sourced from PubChem (CID 133322670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).