(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide

C17H20N6O2 — CID 128987699

IUPAC(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide
SMILESCCn1ccnc1[C@@H]1OCC[C@H]1C(=O)Nc1nnc2cc(C)ccn12
InChIInChI=1S/C17H20N6O2/c1-3-22-8-6-18-15(22)14-12(5-9-25-14)16(24)19-17-21-20-13-10-11(2)4-7-23(13)17/h4,6-8,10,12,14H,3,5,9H2,1-2H3,(H,19,21,24)/t12-,14-/m1/s1
InChIKeyRFQSHTDNRGMTKR-TZMCWYRMSA-N
MW340.39 g/mol
LogP1.97
Rot. Bonds4

About (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide

(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide (PubChem CID 128987699) has the molecular formula C17H20N6O2 and a molecular weight of 340.39 g/mol. Its IUPAC name is (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide
PubChem CID128987699
Molecular FormulaC17H20N6O2
Molecular Weight340.39 g/mol
Exact Mass340.16
IUPAC Name(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide
SMILESCCn1ccnc1[C@@H]1OCC[C@H]1C(=O)Nc1nnc2cc(C)ccn12
InChIInChI=1S/C17H20N6O2/c1-3-22-8-6-18-15(22)14-12(5-9-25-14)16(24)19-17-21-20-13-10-11(2)4-7-23(13)17/h4,6-8,10,12,14H,3,5,9H2,1-2H3,(H,19,21,24)/t12-,14-/m1/s1
InChIKeyRFQSHTDNRGMTKR-TZMCWYRMSA-N
XLogP1.97
TPSA86.34 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.39
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

(2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide
CID 128980252
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(3-ethyl-4-pyridinyl)oxolane-3-carboxamide
CID 128987407
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide
CID 128978576
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(3-methyl-4-pyridinyl)methyl]oxolane-3-carboxamide
CID 128986874
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-7-carboxamide
CID 128986150
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-6-methylpyridine-2-carboxamide
CID 128986179
4-ethyl-N-[(2R,3R)-2-(1-ethylimidazol-2-yl)oxan-3-yl]pyridine-2-carboxamide
CID 136588223
(2R,3R)-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-ethylimidazol-2-yl)-N-methyloxolane-3-carboxamide
CID 128986828
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-5-methyl-1,2,4-oxadiazole-3-carboxamide
CID 128977398
5-ethyl-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]furan-2-carboxamide
CID 128986202
1-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-3-(3-methyl-4-pyridinyl)urea
CID 167864411
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-1-benzofuran-2-carboxamide
CID 128986111

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide?
The IUPAC name of (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide (CID 128987699) is (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide.
What is the SMILES notation for (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide?
The canonical SMILES for (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide is CCn1ccnc1[C@@H]1OCC[C@H]1C(=O)Nc1nnc2cc(C)ccn12.
What is the InChIKey of (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide?
The InChIKey is RFQSHTDNRGMTKR-TZMCWYRMSA-N. The full InChI is InChI=1S/C17H20N6O2/c1-3-22-8-6-18-15(22)14-12(5-9-25-14)16(24)19-17-21-20-13-10-11(2)4-7-23(13)17/h4,6-8,10,12,14H,3,5,9H2,1-2H3,(H,19,21,24)/t12-,14-/m1/s1.
What are the key properties of (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide?
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide has a molecular weight of 340.39 g/mol, XLogP of 1.97, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide is sourced from PubChem (CID 128987699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).