(2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide

C11H16N4O3S — CID 97225540

IUPAC(2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide
SMILESCc1csc(NC(=O)NC[C@H]2CC[C@H](C(N)=O)O2)n1
InChIInChI=1S/C11H16N4O3S/c1-6-5-19-11(14-6)15-10(17)13-4-7-2-3-8(18-7)9(12)16/h5,7-8H,2-4H2,1H3,(H2,12,16)(H2,13,14,15,17)/t7-,8-/m1/s1
InChIKeyKLOZGGNJLWEODL-HTQZYQBOSA-N
MW284.34 g/mol
LogP0.61
Rot. Bonds4

About (2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide

(2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide (PubChem CID 97225540) has the molecular formula C11H16N4O3S and a molecular weight of 284.34 g/mol. Its IUPAC name is (2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide
PubChem CID97225540
Molecular FormulaC11H16N4O3S
Molecular Weight284.34 g/mol
Exact Mass284.09
IUPAC Name(2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide
SMILESCc1csc(NC(=O)NC[C@H]2CC[C@H](C(N)=O)O2)n1
InChIInChI=1S/C11H16N4O3S/c1-6-5-19-11(14-6)15-10(17)13-4-7-2-3-8(18-7)9(12)16/h5,7-8H,2-4H2,1H3,(H2,12,16)(H2,13,14,15,17)/t7-,8-/m1/s1
InChIKeyKLOZGGNJLWEODL-HTQZYQBOSA-N
XLogP0.61
TPSA106.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 50.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide with MolForge

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Related Compounds

5-[[(4-acetylphenyl)carbamoylamino]methyl]oxolane-2-carboxamide
CID 75380134
(2R,5R)-5-[[(3-bromo-4-methylthiophene-2-carbonyl)amino]methyl]oxolane-2-carboxamide
CID 99835307
(2R,5S)-5-[[(3-bromo-4-methylthiophene-2-carbonyl)amino]methyl]oxolane-2-carboxamide
CID 99835306
5-[[(6-methylpyrimidin-4-yl)amino]methyl]oxolane-2-carboxamide
CID 133380624
1-[4-(cyclopentylmethylamino)phenyl]-3-(4-methyl-1,3-thiazol-2-yl)urea
CID 86882671
1-cyclohexyl-3-(4-methyl-1,3-thiazol-2-yl)urea
CID 4129191
2-amino-2-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 60867878
1-(2-ethylcyclohexyl)-3-(4-methyl-1,3-thiazol-2-yl)urea
CID 78871885
5-[[(2-methylpyrimidin-4-yl)amino]methyl]oxolane-2-carboxamide
CID 133380627
(2S)-N-(4-methyl-1,3-thiazol-2-yl)oxolane-2-carboxamide
CID 1086809
(2S,5R)-5-(aminomethyl)-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide;hydrochloride
CID 120783531
ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide
CID 143608697

Frequently Asked Questions

What is the IUPAC name of (2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide?
The IUPAC name of (2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide (CID 97225540) is (2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide.
What is the SMILES notation for (2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide?
The canonical SMILES for (2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide is Cc1csc(NC(=O)NC[C@H]2CC[C@H](C(N)=O)O2)n1.
What is the InChIKey of (2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide?
The InChIKey is KLOZGGNJLWEODL-HTQZYQBOSA-N. The full InChI is InChI=1S/C11H16N4O3S/c1-6-5-19-11(14-6)15-10(17)13-4-7-2-3-8(18-7)9(12)16/h5,7-8H,2-4H2,1H3,(H2,12,16)(H2,13,14,15,17)/t7-,8-/m1/s1.
What are the key properties of (2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide?
(2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide has a molecular weight of 284.34 g/mol, XLogP of 0.61, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-5-[[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]methyl]oxolane-2-carboxamide is sourced from PubChem (CID 97225540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).