N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine

C16H26N4O3S — CID 133430518

IUPACN-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
SMILESCN1CCCC(CNc2ccc(S(=O)(=O)N3CCOCC3)cn2)C1
InChIInChI=1S/C16H26N4O3S/c1-19-6-2-3-14(13-19)11-17-16-5-4-15(12-18-16)24(21,22)20-7-9-23-10-8-20/h4-5,12,14H,2-3,6-11,13H2,1H3,(H,17,18)
InChIKeyXHAXSRNZWNXNIH-UHFFFAOYSA-N
MW354.48 g/mol
LogP0.86
Rot. Bonds5

About N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine

N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine (PubChem CID 133430518) has the molecular formula C16H26N4O3S and a molecular weight of 354.48 g/mol. Its IUPAC name is N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine.

Molecular Properties

Compound NameN-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
PubChem CID133430518
Molecular FormulaC16H26N4O3S
Molecular Weight354.48 g/mol
Exact Mass354.17
IUPAC NameN-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
SMILESCN1CCCC(CNc2ccc(S(=O)(=O)N3CCOCC3)cn2)C1
InChIInChI=1S/C16H26N4O3S/c1-19-6-2-3-14(13-19)11-17-16-5-4-15(12-18-16)24(21,22)20-7-9-23-10-8-20/h4-5,12,14H,2-3,6-11,13H2,1H3,(H,17,18)
InChIKeyXHAXSRNZWNXNIH-UHFFFAOYSA-N
XLogP0.86
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.48
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 133306070
6-(ethylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-sulfonamide
CID 62158948
N-butyl-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 5268046
2-[4-[[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol
CID 133281384
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-(1-benzylpiperidin-3-yl)-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 60503346
N-(2-cyclopentylethyl)-5-piperidin-1-ylsulfonylpyridin-2-amine
CID 55566148
5-morpholin-4-ylsulfonyl-N-[(1-phenylcyclobutyl)methyl]pyridin-2-amine
CID 47018135
5-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridin-2-amine
CID 60856626
N-(3,4-dihydro-2H-chromen-4-ylmethyl)-5-piperidin-1-ylsulfonylpyridin-2-amine
CID 133293402
N-ethyl-5-(4-methylazepan-1-yl)sulfonylpyridin-2-amine
CID 63626896

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine?
The IUPAC name of N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine (CID 133430518) is N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine.
What is the SMILES notation for N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine?
The canonical SMILES for N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine is CN1CCCC(CNc2ccc(S(=O)(=O)N3CCOCC3)cn2)C1.
What is the InChIKey of N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine?
The InChIKey is XHAXSRNZWNXNIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O3S/c1-19-6-2-3-14(13-19)11-17-16-5-4-15(12-18-16)24(21,22)20-7-9-23-10-8-20/h4-5,12,14H,2-3,6-11,13H2,1H3,(H,17,18).
What are the key properties of N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine?
N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine has a molecular weight of 354.48 g/mol, XLogP of 0.86, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpiperidin-3-yl)methyl]-5-morpholin-4-ylsulfonylpyridin-2-amine is sourced from PubChem (CID 133430518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).