N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide

C20H21N3O2 — CID 122284723

IUPACN-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide
SMILESCc1ccn2cc(-c3ccc(NC(=O)C4CCOCC4)cc3)nc2c1
InChIInChI=1S/C20H21N3O2/c1-14-6-9-23-13-18(22-19(23)12-14)15-2-4-17(5-3-15)21-20(24)16-7-10-25-11-8-16/h2-6,9,12-13,16H,7-8,10-11H2,1H3,(H,21,24)
InChIKeyUNVMYDAAUDQLLX-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.67
Rot. Bonds3

About N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide

N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide (PubChem CID 122284723) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide.

Molecular Properties

Compound NameN-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide
PubChem CID122284723
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC NameN-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide
SMILESCc1ccn2cc(-c3ccc(NC(=O)C4CCOCC4)cc3)nc2c1
InChIInChI=1S/C20H21N3O2/c1-14-6-9-23-13-18(22-19(23)12-14)15-2-4-17(5-3-15)21-20(24)16-7-10-25-11-8-16/h2-6,9,12-13,16H,7-8,10-11H2,1H3,(H,21,24)
InChIKeyUNVMYDAAUDQLLX-UHFFFAOYSA-N
XLogP3.67
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide?
The IUPAC name of N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide (CID 122284723) is N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide.
What is the SMILES notation for N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide?
The canonical SMILES for N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide is Cc1ccn2cc(-c3ccc(NC(=O)C4CCOCC4)cc3)nc2c1.
What is the InChIKey of N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide?
The InChIKey is UNVMYDAAUDQLLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-14-6-9-23-13-18(22-19(23)12-14)15-2-4-17(5-3-15)21-20(24)16-7-10-25-11-8-16/h2-6,9,12-13,16H,7-8,10-11H2,1H3,(H,21,24).
What are the key properties of N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide?
N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 3.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]oxane-4-carboxamide is sourced from PubChem (CID 122284723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).