N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide

C11H13N3O2S — CID 110872139

IUPACN-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide
SMILESO=C(NCc1csc2nccn12)C1CCCO1
InChIInChI=1S/C11H13N3O2S/c15-10(9-2-1-5-16-9)13-6-8-7-17-11-12-3-4-14(8)11/h3-4,7,9H,1-2,5-6H2,(H,13,15)
InChIKeyQNQNBJXFFMSCSP-UHFFFAOYSA-N
MW251.31 g/mol
LogP1.19
Rot. Bonds3

About N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide

N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide (PubChem CID 110872139) has the molecular formula C11H13N3O2S and a molecular weight of 251.31 g/mol. Its IUPAC name is N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide
PubChem CID110872139
Molecular FormulaC11H13N3O2S
Molecular Weight251.31 g/mol
Exact Mass251.07
IUPAC NameN-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide
SMILESO=C(NCc1csc2nccn12)C1CCCO1
InChIInChI=1S/C11H13N3O2S/c15-10(9-2-1-5-16-9)13-6-8-7-17-11-12-3-4-14(8)11/h3-4,7,9H,1-2,5-6H2,(H,13,15)
InChIKeyQNQNBJXFFMSCSP-UHFFFAOYSA-N
XLogP1.19
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-ylmethyl)oxolane-2-carboxamide
CID 110401668
(2S)-N-[(4-bromothiophen-2-yl)methyl]oxolane-2-carboxamide
CID 103872325
N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide
CID 60977507
(2S)-N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide
CID 103872510
N-[[2-(methylamino)-1,3-thiazol-4-yl]methyl]oxolane-2-carboxamide
CID 110719509
N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide
CID 108748806
(2S)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide
CID 35855214
(2R)-N-[[1-(3-phenylpropyl)imidazol-2-yl]methyl]oxolane-2-carboxamide
CID 96570710
(2R)-N-[(2-thiophen-2-yl-3-pyridinyl)methyl]oxolane-2-carboxamide
CID 100745825
(2R)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]oxolane-2-carboxamide
CID 29214742
(2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide
CID 128972669
2-[(2-imidazo[2,1-b][1,3]thiazol-3-ylacetyl)amino]-2-(oxan-3-yl)acetic acid
CID 120547799

Frequently Asked Questions

What is the IUPAC name of N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide?
The IUPAC name of N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide (CID 110872139) is N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide?
The canonical SMILES for N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide is O=C(NCc1csc2nccn12)C1CCCO1.
What is the InChIKey of N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide?
The InChIKey is QNQNBJXFFMSCSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2S/c15-10(9-2-1-5-16-9)13-6-8-7-17-11-12-3-4-14(8)11/h3-4,7,9H,1-2,5-6H2,(H,13,15).
What are the key properties of N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide?
N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide has a molecular weight of 251.31 g/mol, XLogP of 1.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)oxolane-2-carboxamide is sourced from PubChem (CID 110872139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).