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

C19H23N5O2 — CID 128980252

IUPAC(2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide
SMILESCCn1ccnc1[C@@H]1OCC[C@H]1C(=O)NCc1cn2ccc(C)cc2n1
InChIInChI=1S/C19H23N5O2/c1-3-23-8-6-20-18(23)17-15(5-9-26-17)19(25)21-11-14-12-24-7-4-13(2)10-16(24)22-14/h4,6-8,10,12,15,17H,3,5,9,11H2,1-2H3,(H,21,25)/t15-,17-/m1/s1
InChIKeyAVAFAVZSIWWUFO-NVXWUHKLSA-N
MW353.43 g/mol
LogP2.25
Rot. Bonds5

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

(2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide (PubChem CID 128980252) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is (2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name(2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide
PubChem CID128980252
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name(2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide
SMILESCCn1ccnc1[C@@H]1OCC[C@H]1C(=O)NCc1cn2ccc(C)cc2n1
InChIInChI=1S/C19H23N5O2/c1-3-23-8-6-20-18(23)17-15(5-9-26-17)19(25)21-11-14-12-24-7-4-13(2)10-16(24)22-14/h4,6-8,10,12,15,17H,3,5,9,11H2,1-2H3,(H,21,25)/t15-,17-/m1/s1
InChIKeyAVAFAVZSIWWUFO-NVXWUHKLSA-N
XLogP2.25
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide?
The IUPAC name of (2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide (CID 128980252) is (2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide.
What is the SMILES notation for (2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide?
The canonical SMILES for (2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide is CCn1ccnc1[C@@H]1OCC[C@H]1C(=O)NCc1cn2ccc(C)cc2n1.
What is the InChIKey of (2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide?
The InChIKey is AVAFAVZSIWWUFO-NVXWUHKLSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-3-23-8-6-20-18(23)17-15(5-9-26-17)19(25)21-11-14-12-24-7-4-13(2)10-16(24)22-14/h4,6-8,10,12,15,17H,3,5,9,11H2,1-2H3,(H,21,25)/t15-,17-/m1/s1.
What are the key properties of (2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide?
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide has a molecular weight of 353.43 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide is sourced from PubChem (CID 128980252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).