(2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide

C18H21N5O2 — CID 128970673

IUPAC(2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide
SMILESCc1ccc2nc(CNC(=O)[C@@H]3CCO[C@H]3c3nccn3C)cn2c1
InChIInChI=1S/C18H21N5O2/c1-12-3-4-15-21-13(11-23(15)10-12)9-20-18(24)14-5-8-25-16(14)17-19-6-7-22(17)2/h3-4,6-7,10-11,14,16H,5,8-9H2,1-2H3,(H,20,24)/t14-,16-/m1/s1
InChIKeyDDCRNYXQIXJAJC-GDBMZVCRSA-N
MW339.40 g/mol
LogP1.77
Rot. Bonds4

About (2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide

(2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide (PubChem CID 128970673) has the molecular formula C18H21N5O2 and a molecular weight of 339.40 g/mol. Its IUPAC name is (2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name(2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide
PubChem CID128970673
Molecular FormulaC18H21N5O2
Molecular Weight339.40 g/mol
Exact Mass339.17
IUPAC Name(2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide
SMILESCc1ccc2nc(CNC(=O)[C@@H]3CCO[C@H]3c3nccn3C)cn2c1
InChIInChI=1S/C18H21N5O2/c1-12-3-4-15-21-13(11-23(15)10-12)9-20-18(24)14-5-8-25-16(14)17-19-6-7-22(17)2/h3-4,6-7,10-11,14,16H,5,8-9H2,1-2H3,(H,20,24)/t14-,16-/m1/s1
InChIKeyDDCRNYXQIXJAJC-GDBMZVCRSA-N
XLogP1.77
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide?
The IUPAC name of (2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide (CID 128970673) is (2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide.
What is the SMILES notation for (2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide?
The canonical SMILES for (2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide is Cc1ccc2nc(CNC(=O)[C@@H]3CCO[C@H]3c3nccn3C)cn2c1.
What is the InChIKey of (2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide?
The InChIKey is DDCRNYXQIXJAJC-GDBMZVCRSA-N. The full InChI is InChI=1S/C18H21N5O2/c1-12-3-4-15-21-13(11-23(15)10-12)9-20-18(24)14-5-8-25-16(14)17-19-6-7-22(17)2/h3-4,6-7,10-11,14,16H,5,8-9H2,1-2H3,(H,20,24)/t14-,16-/m1/s1.
What are the key properties of (2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide?
(2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide is sourced from PubChem (CID 128970673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).