(2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide

C18H21NO5S — CID 95269930

IUPAC(2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide
SMILESC[C@@H](OC[C@@H]1CCCO1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C18H21NO5S/c1-13(24-12-16-7-4-10-23-16)18(20)19-25(21,22)17-9-8-14-5-2-3-6-15(14)11-17/h2-3,5-6,8-9,11,13,16H,4,7,10,12H2,1H3,(H,19,20)/t13-,16+/m1/s1
InChIKeyXDIZSZRGMJUDCN-CJNGLKHVSA-N
MW363.44 g/mol
LogP2.23
Rot. Bonds6

About (2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide

(2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide (PubChem CID 95269930) has the molecular formula C18H21NO5S and a molecular weight of 363.44 g/mol. Its IUPAC name is (2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide.

Molecular Properties

Compound Name(2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide
PubChem CID95269930
Molecular FormulaC18H21NO5S
Molecular Weight363.44 g/mol
Exact Mass363.11
IUPAC Name(2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide
SMILESC[C@@H](OC[C@@H]1CCCO1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C18H21NO5S/c1-13(24-12-16-7-4-10-23-16)18(20)19-25(21,22)17-9-8-14-5-2-3-6-15(14)11-17/h2-3,5-6,8-9,11,13,16H,4,7,10,12H2,1H3,(H,19,20)/t13-,16+/m1/s1
InChIKeyXDIZSZRGMJUDCN-CJNGLKHVSA-N
XLogP2.23
TPSA81.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.44
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-(3-methylphenyl)sulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide
CID 95269998
N-(3-methylphenyl)sulfonyl-2-(oxolan-2-ylmethoxy)propanamide
CID 75417596
(2R)-N-(benzenesulfonyl)-2-[[(2R)-oxan-2-yl]methoxy]propanamide
CID 95272601
(2R)-N-(3-chlorophenyl)sulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide
CID 95269990
N-(3-chlorophenyl)sulfonyl-2-(oxolan-2-ylmethoxy)propanamide
CID 71884570
N-(4-chlorophenyl)sulfonyl-2-(oxolan-2-ylmethoxy)propanamide
CID 71884607
(2R)-N-(3-cyanophenyl)sulfonyl-2-[[(2R)-oxolan-2-yl]methoxy]propanamide
CID 95270061
N-(3-cyanophenyl)sulfonyl-2-(oxan-2-ylmethoxy)propanamide
CID 71882542
(2R)-N-(2,5-dimethylphenyl)sulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide
CID 95269973
(2R)-2-[[(2R)-oxan-2-yl]methoxy]-N-thiophen-2-ylsulfonylpropanamide
CID 95272613
(2R)-N-[(5-chloro-2-pyridinyl)sulfonyl]-2-[[(2R)-oxolan-2-yl]methoxy]propanamide
CID 99807154
N-[3-(tert-butylsulfamoyl)phenyl]-2-(oxolan-2-ylmethoxy)propanamide
CID 48849651

Frequently Asked Questions

What is the IUPAC name of (2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide?
The IUPAC name of (2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide (CID 95269930) is (2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide.
What is the SMILES notation for (2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide?
The canonical SMILES for (2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide is C[C@@H](OC[C@@H]1CCCO1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of (2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide?
The InChIKey is XDIZSZRGMJUDCN-CJNGLKHVSA-N. The full InChI is InChI=1S/C18H21NO5S/c1-13(24-12-16-7-4-10-23-16)18(20)19-25(21,22)17-9-8-14-5-2-3-6-15(14)11-17/h2-3,5-6,8-9,11,13,16H,4,7,10,12H2,1H3,(H,19,20)/t13-,16+/m1/s1.
What are the key properties of (2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide?
(2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide has a molecular weight of 363.44 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-naphthalen-2-ylsulfonyl-2-[[(2S)-oxolan-2-yl]methoxy]propanamide is sourced from PubChem (CID 95269930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).