N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide

C9H16N2O4S — CID 110315632

IUPACN-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide
SMILESCCS(=O)(=O)NCC1CN(C2CC2)C(=O)O1
InChIInChI=1S/C9H16N2O4S/c1-2-16(13,14)10-5-8-6-11(7-3-4-7)9(12)15-8/h7-8,10H,2-6H2,1H3
InChIKeySCAJYGCRAJZHGA-UHFFFAOYSA-N
MW248.30 g/mol
LogP-0.09
Rot. Bonds5

About N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide

N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide (PubChem CID 110315632) has the molecular formula C9H16N2O4S and a molecular weight of 248.30 g/mol. Its IUPAC name is N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide.

Molecular Properties

Compound NameN-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide
PubChem CID110315632
Molecular FormulaC9H16N2O4S
Molecular Weight248.30 g/mol
Exact Mass248.08
IUPAC NameN-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide
SMILESCCS(=O)(=O)NCC1CN(C2CC2)C(=O)O1
InChIInChI=1S/C9H16N2O4S/c1-2-16(13,14)10-5-8-6-11(7-3-4-7)9(12)15-8/h7-8,10H,2-6H2,1H3
InChIKeySCAJYGCRAJZHGA-UHFFFAOYSA-N
XLogP-0.09
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.30
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1-(2-methylphenyl)methanesulfonamide
CID 110315671
N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide
CID 110726007
N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-4-methoxy-2,6-dimethylbenzenesulfonamide
CID 110315686
N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide
CID 110315678
N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-4-(2,5-dimethyl-1,3-oxazol-4-yl)benzenesulfonamide
CID 110634121
2-cyclopentyl-N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]propanamide
CID 110354921
2-(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)acetic acid
CID 82406326
N-[[3-(3-methoxyphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]ethanesulfonamide
CID 16922720
4-tert-butyl-N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
CID 110315571
3-cyclopentyl-5-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 90189648
1-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylurea
CID 110315593
(5R)-5-(hydroxymethyl)-3-(1-methylpiperidin-4-yl)-1,3-oxazolidin-2-one
CID 115056583

Frequently Asked Questions

What is the IUPAC name of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide?
The IUPAC name of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide (CID 110315632) is N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide.
What is the SMILES notation for N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide?
The canonical SMILES for N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide is CCS(=O)(=O)NCC1CN(C2CC2)C(=O)O1.
What is the InChIKey of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide?
The InChIKey is SCAJYGCRAJZHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O4S/c1-2-16(13,14)10-5-8-6-11(7-3-4-7)9(12)15-8/h7-8,10H,2-6H2,1H3.
What are the key properties of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide?
N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide has a molecular weight of 248.30 g/mol, XLogP of -0.09, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]ethanesulfonamide is sourced from PubChem (CID 110315632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).