4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide

C11H22N2O4S — CID 66259891

IUPAC4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)NC(C)CS(C)(=O)=O
InChIInChI=1S/C11H22N2O4S/c1-4-12-10-6-17-5-9(10)11(14)13-8(2)7-18(3,15)16/h8-10,12H,4-7H2,1-3H3,(H,13,14)
InChIKeyAARAZENRFUEPOU-UHFFFAOYSA-N
MW278.37 g/mol
LogP-0.84
Rot. Bonds6

About 4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide

4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide (PubChem CID 66259891) has the molecular formula C11H22N2O4S and a molecular weight of 278.37 g/mol. Its IUPAC name is 4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide
PubChem CID66259891
Molecular FormulaC11H22N2O4S
Molecular Weight278.37 g/mol
Exact Mass278.13
IUPAC Name4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)NC(C)CS(C)(=O)=O
InChIInChI=1S/C11H22N2O4S/c1-4-12-10-6-17-5-9(10)11(14)13-8(2)7-18(3,15)16/h8-10,12H,4-7H2,1-3H3,(H,13,14)
InChIKeyAARAZENRFUEPOU-UHFFFAOYSA-N
XLogP-0.84
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 5-0.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(ethylamino)-N-(4-hydroxybutan-2-yl)oxolane-3-carboxamide
CID 83177200
N-[(1R)-1-cyclopentylethyl]-4-(ethylamino)oxolane-3-carboxamide
CID 81391586
4-(ethylamino)-N-ethylsulfonyloxolane-3-carboxamide
CID 103306914
(2R)-2-[[4-(ethylamino)oxolane-3-carbonyl]amino]butanoic acid
CID 66258745
4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide
CID 66257493
N-heptan-2-yl-4-(methylamino)oxolane-3-carboxamide
CID 66267744
4-(ethylamino)-N-(1-methoxy-3-methylbutan-2-yl)oxolane-3-carboxamide
CID 66258351
4-(ethylamino)-N-(2-methyl-2-methylsulfonylpropyl)oxolane-3-carboxamide
CID 79549781
4-(ethylamino)-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]oxolane-3-carboxamide
CID 66258672
N-[1-(2-chlorophenyl)propan-2-yl]-4-(ethylamino)oxolane-3-carboxamide
CID 66257504
propan-2-yl 4-(ethylamino)oxolane-3-carboxylate
CID 66247148
(2R)-2-[[4-(ethylamino)oxolane-3-carbonyl]amino]-4-hydroxybutanoic acid
CID 114005252

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide?
The IUPAC name of 4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide (CID 66259891) is 4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide.
What is the SMILES notation for 4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide?
The canonical SMILES for 4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide is CCNC1COCC1C(=O)NC(C)CS(C)(=O)=O.
What is the InChIKey of 4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide?
The InChIKey is AARAZENRFUEPOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4S/c1-4-12-10-6-17-5-9(10)11(14)13-8(2)7-18(3,15)16/h8-10,12H,4-7H2,1-3H3,(H,13,14).
What are the key properties of 4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide?
4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide has a molecular weight of 278.37 g/mol, XLogP of -0.84, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide is sourced from PubChem (CID 66259891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).