3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide

C15H23N3O5S — CID 91789955

IUPAC3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide
SMILESCc1ccc(O[C@H]2CCOC[C@H]2NC(=O)CCNS(C)(=O)=O)cn1
InChIInChI=1S/C15H23N3O5S/c1-11-3-4-12(9-16-11)23-14-6-8-22-10-13(14)18-15(19)5-7-17-24(2,20)21/h3-4,9,13-14,17H,5-8,10H2,1-2H3,(H,18,19)/t13-,14+/m1/s1
InChIKeyCYFNIJPVMUSBFP-KGLIPLIRSA-N
MW357.43 g/mol
LogP-0.02
Rot. Bonds7

About 3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide

3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide (PubChem CID 91789955) has the molecular formula C15H23N3O5S and a molecular weight of 357.43 g/mol. Its IUPAC name is 3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide.

Molecular Properties

Compound Name3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide
PubChem CID91789955
Molecular FormulaC15H23N3O5S
Molecular Weight357.43 g/mol
Exact Mass357.14
IUPAC Name3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide
SMILESCc1ccc(O[C@H]2CCOC[C@H]2NC(=O)CCNS(C)(=O)=O)cn1
InChIInChI=1S/C15H23N3O5S/c1-11-3-4-12(9-16-11)23-14-6-8-22-10-13(14)18-15(19)5-7-17-24(2,20)21/h3-4,9,13-14,17H,5-8,10H2,1-2H3,(H,18,19)/t13-,14+/m1/s1
InChIKeyCYFNIJPVMUSBFP-KGLIPLIRSA-N
XLogP-0.02
TPSA106.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]-3-pyrazin-2-ylpropanamide
CID 91760405
3-(methanesulfonamido)-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]propanamide
CID 91792493
4-[(3R,4R)-3-[[2-(methanesulfonamido)acetyl]amino]oxan-4-yl]oxybenzoic acid
CID 91765912
N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]-1-phenylcyclopropane-1-carboxamide
CID 91786809
N-[(3S,4S)-3-[(6-methyl-3-pyridinyl)oxy]oxan-4-yl]-3-(oxazinan-2-yl)propanamide
CID 133267645
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3R,4R)-3-[(6-methyl-3-pyridinyl)oxy]oxan-4-yl]acetamide
CID 91777974
N-[(3S,4R)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]-1-benzofuran-3-carboxamide
CID 133264780
2-methyl-N-[(3R,4R)-3-[(6-methyl-3-pyridinyl)oxy]oxan-4-yl]propanamide
CID 91787096
N-[(3S,4S)-3-[(6-methyl-3-pyridinyl)oxy]oxan-4-yl]-2-(triazol-1-yl)acetamide
CID 133267072
2-(2,5-dioxoimidazolidin-1-yl)-N-[(3S,4S)-3-[(6-methyl-3-pyridinyl)oxy]oxan-4-yl]acetamide
CID 133260661
N-[(3S,4R)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]imidazo[1,2-a]pyridine-2-carboxamide
CID 133260542
N-[(3R,4R)-3-[(6-methyl-3-pyridinyl)oxy]oxan-4-yl]-2-(2-oxopyrimidin-1-yl)acetamide
CID 91762296

Frequently Asked Questions

What is the IUPAC name of 3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide?
The IUPAC name of 3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide (CID 91789955) is 3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide.
What is the SMILES notation for 3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide?
The canonical SMILES for 3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide is Cc1ccc(O[C@H]2CCOC[C@H]2NC(=O)CCNS(C)(=O)=O)cn1.
What is the InChIKey of 3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide?
The InChIKey is CYFNIJPVMUSBFP-KGLIPLIRSA-N. The full InChI is InChI=1S/C15H23N3O5S/c1-11-3-4-12(9-16-11)23-14-6-8-22-10-13(14)18-15(19)5-7-17-24(2,20)21/h3-4,9,13-14,17H,5-8,10H2,1-2H3,(H,18,19)/t13-,14+/m1/s1.
What are the key properties of 3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide?
3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide has a molecular weight of 357.43 g/mol, XLogP of -0.02, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methanesulfonamido)-N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]propanamide is sourced from PubChem (CID 91789955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).