2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide

C10H14N2O4S — CID 47307987

IUPAC2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide
SMILESCOC(C)C(=O)Nc1ccc(S(C)(=O)=O)nc1
InChIInChI=1S/C10H14N2O4S/c1-7(16-2)10(13)12-8-4-5-9(11-6-8)17(3,14)15/h4-7H,1-3H3,(H,12,13)
InChIKeyBOBSYFRFSVNXKF-UHFFFAOYSA-N
MW258.30 g/mol
LogP0.46
Rot. Bonds4

About 2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide

2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide (PubChem CID 47307987) has the molecular formula C10H14N2O4S and a molecular weight of 258.30 g/mol. Its IUPAC name is 2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide.

Molecular Properties

Compound Name2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide
PubChem CID47307987
Molecular FormulaC10H14N2O4S
Molecular Weight258.30 g/mol
Exact Mass258.07
IUPAC Name2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide
SMILESCOC(C)C(=O)Nc1ccc(S(C)(=O)=O)nc1
InChIInChI=1S/C10H14N2O4S/c1-7(16-2)10(13)12-8-4-5-9(11-6-8)17(3,14)15/h4-7H,1-3H3,(H,12,13)
InChIKeyBOBSYFRFSVNXKF-UHFFFAOYSA-N
XLogP0.46
TPSA85.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-amino-N-(6-methylsulfonyl-3-pyridinyl)propanamide
CID 78972498
4-amino-2-methyl-N-(6-methylsulfonyl-3-pyridinyl)butanamide
CID 80543396
2-methoxy-N-(4-methylsulfonylphenyl)propanamide
CID 47300837
3-methyl-N-(6-methylsulfonyl-3-pyridinyl)butanamide
CID 47212321
2-chloro-N-(6-methylsulfonyl-3-pyridinyl)acetamide
CID 43696835
2-methyl-3-[(6-methylsulfonyl-3-pyridinyl)amino]butan-2-ol
CID 65338019
2-[5-(2-methoxypropanoylamino)-2-pyridinyl]acetic acid
CID 107339238
4-amino-3-methyl-N-(6-methylsulfonyl-3-pyridinyl)butanamide
CID 81075258
2-[2-[(6-methylsulfonyl-3-pyridinyl)amino]-2-oxoethoxy]acetic acid
CID 61329211
(2S)-2-amino-4-methylsulfanyl-N-(6-methylsulfonyl-3-pyridinyl)butanamide;dihydrochloride
CID 119854939
4-methyl-N-(6-methylsulfonyl-3-pyridinyl)benzamide
CID 47037064
N-methyl-6-methylsulfonylpyridin-3-amine
CID 63091077

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide?
The IUPAC name of 2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide (CID 47307987) is 2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide.
What is the SMILES notation for 2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide?
The canonical SMILES for 2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide is COC(C)C(=O)Nc1ccc(S(C)(=O)=O)nc1.
What is the InChIKey of 2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide?
The InChIKey is BOBSYFRFSVNXKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O4S/c1-7(16-2)10(13)12-8-4-5-9(11-6-8)17(3,14)15/h4-7H,1-3H3,(H,12,13).
What are the key properties of 2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide?
2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide has a molecular weight of 258.30 g/mol, XLogP of 0.46, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(6-methylsulfonyl-3-pyridinyl)propanamide is sourced from PubChem (CID 47307987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).