4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide

C18H17N3O2 — CID 9400053

IUPAC4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1
InChIInChI=1S/C18H17N3O2/c1-2-10-19-18(22)14-6-8-16(9-7-14)23-13-15-12-21-11-4-3-5-17(21)20-15/h2-9,11-12H,1,10,13H2,(H,19,22)
InChIKeyMDZCDHXGZHPIAX-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.83
Rot. Bonds6

About 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide

4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide (PubChem CID 9400053) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide.

Molecular Properties

Compound Name4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide
PubChem CID9400053
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC Name4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1
InChIInChI=1S/C18H17N3O2/c1-2-10-19-18(22)14-6-8-16(9-7-14)23-13-15-12-21-11-4-3-5-17(21)20-15/h2-9,11-12H,1,10,13H2,(H,19,22)
InChIKeyMDZCDHXGZHPIAX-UHFFFAOYSA-N
XLogP2.83
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-N-prop-2-enylbenzamide
CID 31765000
N-[(3-chlorophenyl)methyl]-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 9402179
N-(3,5-difluorophenyl)-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 25406496
4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide
CID 27861009
N-[(3S)-1,1-dioxothiolan-3-yl]-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 27710930
4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1R,2R)-2-methylcyclohexyl]benzamide
CID 40723884
N-[1-[4-(imidazo[1,2-a]pyridin-2-ylmethoxy)anilino]-3-methyl-1-oxobutan-2-yl]benzamide
CID 86894155
2-(phenoxymethyl)imidazo[1,2-a]pyridine
CID 4702052
4-ethoxy-N-[2-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-2-oxoethyl]benzamide
CID 25429958
4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(3-methylsulfanylphenyl)benzamide
CID 40723689
N-(2-fluoro-5-methylphenyl)-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 40722968
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[3-(methylamino)propyl]benzamide
CID 119431980

Frequently Asked Questions

What is the IUPAC name of 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide?
The IUPAC name of 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide (CID 9400053) is 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide.
What is the SMILES notation for 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide?
The canonical SMILES for 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide is C=CCNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1.
What is the InChIKey of 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide?
The InChIKey is MDZCDHXGZHPIAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-2-10-19-18(22)14-6-8-16(9-7-14)23-13-15-12-21-11-4-3-5-17(21)20-15/h2-9,11-12H,1,10,13H2,(H,19,22).
What are the key properties of 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide?
4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide has a molecular weight of 307.35 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-prop-2-enylbenzamide is sourced from PubChem (CID 9400053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).