6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide

C18H21N3O4S — CID 18149126

IUPAC6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NCc2ccccc2S(=O)(=O)N2CCOCC2)cn1
InChIInChI=1S/C18H21N3O4S/c1-14-6-7-16(13-19-14)18(22)20-12-15-4-2-3-5-17(15)26(23,24)21-8-10-25-11-9-21/h2-7,13H,8-12H2,1H3,(H,20,22)
InChIKeyPTPAZDYWDGQYNQ-UHFFFAOYSA-N
MW375.45 g/mol
LogP1.34
Rot. Bonds5

About 6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide

6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide (PubChem CID 18149126) has the molecular formula C18H21N3O4S and a molecular weight of 375.45 g/mol. Its IUPAC name is 6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide
PubChem CID18149126
Molecular FormulaC18H21N3O4S
Molecular Weight375.45 g/mol
Exact Mass375.13
IUPAC Name6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NCc2ccccc2S(=O)(=O)N2CCOCC2)cn1
InChIInChI=1S/C18H21N3O4S/c1-14-6-7-16(13-19-14)18(22)20-12-15-4-2-3-5-17(15)26(23,24)21-8-10-25-11-9-21/h2-7,13H,8-12H2,1H3,(H,20,22)
InChIKeyPTPAZDYWDGQYNQ-UHFFFAOYSA-N
XLogP1.34
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.45
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-4-carboxamide
CID 33308662
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]acetamide
CID 24582298
N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-phenyl-2,1-benzoxazole-5-carboxamide
CID 24584059
N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-1-benzofuran-2-carboxamide
CID 17442191
3-(cyclopropylsulfamoyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide
CID 24680805
N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-2-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 30797106
1-methyl-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]pyrazole-4-carboxamide
CID 51321501
N-[(2-morpholin-4-ylsulfonylphenyl)methyl]propan-2-amine
CID 60721221
N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 18167940
2-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-thiophen-2-ylpyridine-3-carboxamide
CID 33308674
2-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)benzamide
CID 31972800
2-(difluoromethoxy)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]benzamide
CID 30955346

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide (CID 18149126) is 6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide is Cc1ccc(C(=O)NCc2ccccc2S(=O)(=O)N2CCOCC2)cn1.
What is the InChIKey of 6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide?
The InChIKey is PTPAZDYWDGQYNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4S/c1-14-6-7-16(13-19-14)18(22)20-12-15-4-2-3-5-17(15)26(23,24)21-8-10-25-11-9-21/h2-7,13H,8-12H2,1H3,(H,20,22).
What are the key properties of 6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide?
6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide has a molecular weight of 375.45 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 18149126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).