7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide

C17H18N4O3S — CID 155437335

IUPAC7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1ccns1
InChIInChI=1S/C17H18N4O3S/c1-23-14-8-15-19-13(11-3-6-24-7-4-11)10-21(15)9-12(14)17(22)20-16-2-5-18-25-16/h2,5,8-11H,3-4,6-7H2,1H3,(H,20,22)
InChIKeyWPTBCWARKCSBOP-UHFFFAOYSA-N
MW358.42 g/mol
LogP2.95
Rot. Bonds4

About 7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide

7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 155437335) has the molecular formula C17H18N4O3S and a molecular weight of 358.42 g/mol. Its IUPAC name is 7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID155437335
Molecular FormulaC17H18N4O3S
Molecular Weight358.42 g/mol
Exact Mass358.11
IUPAC Name7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1ccns1
InChIInChI=1S/C17H18N4O3S/c1-23-14-8-15-19-13(11-3-6-24-7-4-11)10-21(15)9-12(14)17(22)20-16-2-5-18-25-16/h2,5,8-11H,3-4,6-7H2,1H3,(H,20,22)
InChIKeyWPTBCWARKCSBOP-UHFFFAOYSA-N
XLogP2.95
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.42
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide (CID 155437335) is 7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide is COc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1ccns1.
What is the InChIKey of 7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is WPTBCWARKCSBOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3S/c1-23-14-8-15-19-13(11-3-6-24-7-4-11)10-21(15)9-12(14)17(22)20-16-2-5-18-25-16/h2,5,8-11H,3-4,6-7H2,1H3,(H,20,22).
What are the key properties of 7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide?
7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 358.42 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 155437335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).