N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine

C15H25N5O3S — CID 133306070

IUPACN-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
SMILESCC1NNC(C)C1CNc1ccc(S(=O)(=O)N2CCOCC2)cn1
InChIInChI=1S/C15H25N5O3S/c1-11-14(12(2)19-18-11)10-17-15-4-3-13(9-16-15)24(21,22)20-5-7-23-8-6-20/h3-4,9,11-12,14,18-19H,5-8,10H2,1-2H3,(H,16,17)
InChIKeyGLPYEMGQYZEUSU-UHFFFAOYSA-N
MW355.46 g/mol
LogP0.02
Rot. Bonds5

About N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine

N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine (PubChem CID 133306070) has the molecular formula C15H25N5O3S and a molecular weight of 355.46 g/mol. Its IUPAC name is N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine.

Molecular Properties

Compound NameN-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
PubChem CID133306070
Molecular FormulaC15H25N5O3S
Molecular Weight355.46 g/mol
Exact Mass355.17
IUPAC NameN-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
SMILESCC1NNC(C)C1CNc1ccc(S(=O)(=O)N2CCOCC2)cn1
InChIInChI=1S/C15H25N5O3S/c1-11-14(12(2)19-18-11)10-17-15-4-3-13(9-16-15)24(21,22)20-5-7-23-8-6-20/h3-4,9,11-12,14,18-19H,5-8,10H2,1-2H3,(H,16,17)
InChIKeyGLPYEMGQYZEUSU-UHFFFAOYSA-N
XLogP0.02
TPSA95.59 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.46
LogP ≤ 50.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

3,5-dimethyl-N'-(5-morpholin-4-ylsulfonyl-2-pyridinyl)pyrazolidine-4-sulfonohydrazide
CID 52987336
N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 133430518
N-butyl-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 5268046
N-[(1S,2S)-2-methylcyclohexyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 9311729
N-(1-ethylpiperidin-4-yl)-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 8566045
N-[(2,5-dimethyl-1,3-thiazol-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 133406165
5-morpholin-4-ylsulfonyl-N-[2-(4-propan-2-ylphenyl)ethyl]pyridin-2-amine
CID 9107195
N-[2-(4-methylphenyl)sulfanylethyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 8565449
N-[2-(4-methoxyphenyl)ethyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 9281322
N-(4-methylphenyl)-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 5268105
methyl 6-[(5-morpholin-4-ylsulfonyl-2-pyridinyl)amino]hexanoate
CID 9107417
5-morpholin-4-ylsulfonyl-N-[[4-(propan-2-yloxymethyl)phenyl]methyl]pyridin-2-amine
CID 55829884

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine?
The IUPAC name of N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine (CID 133306070) is N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine.
What is the SMILES notation for N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine?
The canonical SMILES for N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine is CC1NNC(C)C1CNc1ccc(S(=O)(=O)N2CCOCC2)cn1.
What is the InChIKey of N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine?
The InChIKey is GLPYEMGQYZEUSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O3S/c1-11-14(12(2)19-18-11)10-17-15-4-3-13(9-16-15)24(21,22)20-5-7-23-8-6-20/h3-4,9,11-12,14,18-19H,5-8,10H2,1-2H3,(H,16,17).
What are the key properties of N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine?
N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine has a molecular weight of 355.46 g/mol, XLogP of 0.02, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine is sourced from PubChem (CID 133306070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).