(3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide

C11H14N2O2S — CID 94211482

IUPAC(3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide
SMILESO=C(Nc1nc(C2CC2)cs1)[C@H]1CCOC1
InChIInChI=1S/C11H14N2O2S/c14-10(8-3-4-15-5-8)13-11-12-9(6-16-11)7-1-2-7/h6-8H,1-5H2,(H,12,13,14)/t8-/m0/s1
InChIKeyBPTCDSNXZYNUTQ-QMMMGPOBSA-N
MW238.31 g/mol
LogP2.00
Rot. Bonds3

About (3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide

(3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide (PubChem CID 94211482) has the molecular formula C11H14N2O2S and a molecular weight of 238.31 g/mol. Its IUPAC name is (3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name(3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide
PubChem CID94211482
Molecular FormulaC11H14N2O2S
Molecular Weight238.31 g/mol
Exact Mass238.08
IUPAC Name(3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide
SMILESO=C(Nc1nc(C2CC2)cs1)[C@H]1CCOC1
InChIInChI=1S/C11H14N2O2S/c14-10(8-3-4-15-5-8)13-11-12-9(6-16-11)7-1-2-7/h6-8H,1-5H2,(H,12,13,14)/t8-/m0/s1
InChIKeyBPTCDSNXZYNUTQ-QMMMGPOBSA-N
XLogP2.00
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(2-methylphenyl)-1,3-thiazol-2-yl]oxolane-3-carboxamide
CID 75921279
(1R,3S,5S,6S,7R)-N-(4-cyclopropyl-1,3-thiazol-2-yl)-6,7-dihydroxybicyclo[3.3.1]nonane-3-carboxamide
CID 167897147
(1S)-2,2-dichloro-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide
CID 33302453
N-(4-cyclopropyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
CID 47200518
1-N,4-N-bis(4-cyclopropyl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 32869371
N-(4-acetyl-1,3-thiazol-2-yl)oxane-4-carboxamide
CID 30472924
N-[4-(oxan-4-yl)-1,3-thiazol-2-yl]-3-(triazol-1-yl)cyclobutane-1-carboxamide
CID 166268630
N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-(2,2-dimethylpropanoyl)piperidine-4-carboxamide
CID 32868205
4-[(4-cyclopropyl-1,3-thiazol-2-yl)amino]-4-oxobut-2-enoic acid
CID 61479564
(2R)-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 103795480
3,5-dibromo-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide
CID 107980376
2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-methylpropanamide;hydrochloride
CID 119292978

Frequently Asked Questions

What is the IUPAC name of (3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide?
The IUPAC name of (3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide (CID 94211482) is (3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide.
What is the SMILES notation for (3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide?
The canonical SMILES for (3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide is O=C(Nc1nc(C2CC2)cs1)[C@H]1CCOC1.
What is the InChIKey of (3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide?
The InChIKey is BPTCDSNXZYNUTQ-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H14N2O2S/c14-10(8-3-4-15-5-8)13-11-12-9(6-16-11)7-1-2-7/h6-8H,1-5H2,(H,12,13,14)/t8-/m0/s1.
What are the key properties of (3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide?
(3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide has a molecular weight of 238.31 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide is sourced from PubChem (CID 94211482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).