3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide

C17H22N4O3S — CID 167986336

IUPAC3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide
SMILESCc1nc2ncccc2cc1CCC(=O)NS(=O)(=O)C1CCNCC1
InChIInChI=1S/C17H22N4O3S/c1-12-13(11-14-3-2-8-19-17(14)20-12)4-5-16(22)21-25(23,24)15-6-9-18-10-7-15/h2-3,8,11,15,18H,4-7,9-10H2,1H3,(H,21,22)
InChIKeyOPYSQICHZNVZJW-UHFFFAOYSA-N
MW362.46 g/mol
LogP1.07
Rot. Bonds5

About 3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide

3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide (PubChem CID 167986336) has the molecular formula C17H22N4O3S and a molecular weight of 362.46 g/mol. Its IUPAC name is 3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide.

Molecular Properties

Compound Name3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide
PubChem CID167986336
Molecular FormulaC17H22N4O3S
Molecular Weight362.46 g/mol
Exact Mass362.14
IUPAC Name3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide
SMILESCc1nc2ncccc2cc1CCC(=O)NS(=O)(=O)C1CCNCC1
InChIInChI=1S/C17H22N4O3S/c1-12-13(11-14-3-2-8-19-17(14)20-12)4-5-16(22)21-25(23,24)15-6-9-18-10-7-15/h2-3,8,11,15,18H,4-7,9-10H2,1H3,(H,21,22)
InChIKeyOPYSQICHZNVZJW-UHFFFAOYSA-N
XLogP1.07
TPSA101.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.46
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(1S,2S,4R,5R)-4-[3-(2-methyl-1,8-naphthyridin-3-yl)propanoylamino]bicyclo[3.1.0]hexane-2-carboxylic acid
CID 166307488
3-(2-methyl-1,8-naphthyridin-3-yl)-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-ylmethyl)propanamide
CID 166305429
2-piperidin-4-yl-N-(2-quinolin-8-ylethyl)acetamide;dihydrochloride
CID 119840582
N-[(4-cyclohexylphenyl)methyl]-2-methyl-1,8-naphthyridine-3-carboxamide
CID 46909359
2-methyl-N-piperidin-4-ylpyridin-3-amine
CID 79041620
1-[2-(2-methyl-1,8-naphthyridin-3-yl)ethyl]-3-[(2-methylpropan-2-yl)oxymethyl]pyrazole-4-carboxylic acid
CID 139422177
N-[[4-[2-(hydroxymethyl)piperidin-1-yl]phenyl]methyl]-2-methyl-1,8-naphthyridine-3-carboxamide
CID 46908099
1,8-naphthyridine;piperazine
CID 157389388
2-methyl-N-(pyrrolidin-3-ylmethyl)pyridine-3-carboxamide
CID 80564265
2-(3-methyl-2-pyridinyl)-N-[(3S)-piperidin-3-yl]acetamide
CID 107148570
3-(2-methyl-3-pyridinyl)propanoic acid;hydrochloride
CID 134129731
N-piperidin-4-yl-1-quinolin-8-ylmethanesulfonamide;hydrochloride
CID 119960786

Frequently Asked Questions

What is the IUPAC name of 3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide?
The IUPAC name of 3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide (CID 167986336) is 3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide.
What is the SMILES notation for 3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide?
The canonical SMILES for 3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide is Cc1nc2ncccc2cc1CCC(=O)NS(=O)(=O)C1CCNCC1.
What is the InChIKey of 3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide?
The InChIKey is OPYSQICHZNVZJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3S/c1-12-13(11-14-3-2-8-19-17(14)20-12)4-5-16(22)21-25(23,24)15-6-9-18-10-7-15/h2-3,8,11,15,18H,4-7,9-10H2,1H3,(H,21,22).
What are the key properties of 3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide?
3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide has a molecular weight of 362.46 g/mol, XLogP of 1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyl-1,8-naphthyridin-3-yl)-N-piperidin-4-ylsulfonylpropanamide is sourced from PubChem (CID 167986336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).