4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile

C19H17N3O2 — CID 163838969

IUPAC4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile
SMILESCC1(COc2ccn3c(-c4ccc(C#N)cc4)cnc3c2)COC1
InChIInChI=1S/C19H17N3O2/c1-19(11-23-12-19)13-24-16-6-7-22-17(10-21-18(22)8-16)15-4-2-14(9-20)3-5-15/h2-8,10H,11-13H2,1H3
InChIKeyOKFOSVBNHDUKBF-UHFFFAOYSA-N
MW319.36 g/mol
LogP3.29
Rot. Bonds4

About 4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile

4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile (PubChem CID 163838969) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is 4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile.

Molecular Properties

Compound Name4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile
PubChem CID163838969
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC Name4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile
SMILESCC1(COc2ccn3c(-c4ccc(C#N)cc4)cnc3c2)COC1
InChIInChI=1S/C19H17N3O2/c1-19(11-23-12-19)13-24-16-6-7-22-17(10-21-18(22)8-16)15-4-2-14(9-20)3-5-15/h2-8,10H,11-13H2,1H3
InChIKeyOKFOSVBNHDUKBF-UHFFFAOYSA-N
XLogP3.29
TPSA59.55 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile with MolForge

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Related Compounds

Sch 28080
CID 108137
2-(4-Propoxyphenyl)imidazo[1,2-a]pyridine
CID 2876085
3,6-Bis(4-isopropoxyphenyl)imidazo[1,2-a]pyridine-7-carbonitrile
CID 146659129
Dimethyl-{3-[4-(8-methyl-imidazo[1,2-a]pyridin-2-yl)-phenoxy]-propyl}-amine
CID 9839643
Dibutyl-{3-[4-(8-methyl-imidazo[1,2-a]pyridin-2-yl)-phenoxy]-propyl}-amine
CID 9865378
{3-[4-(8-Methyl-imidazo[1,2-a]pyridin-2-yl)-phenoxy]-propyl}-dipropyl-amine
CID 9947283
Dibutyl-{3-[4-(3,8-dimethyl-imidazo[1,2-a]pyridin-2-yl)-phenoxy]-propyl}-amine
CID 10179589
4-methoxy-3,5-dimethyl-2-[(E)-2-(1-methyl-4-phenylimidazol-2-yl)ethenyl]pyridine
CID 165414940
2-[4-[7-(4-Methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile
CID 118733901
3-(6-Tert-butylsulfonyl-7-methoxyimidazo[1,2-a]pyridin-3-yl)benzonitrile
CID 145974768
4-[7-[2-(Dimethylamino)ethoxy]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine
CID 155516599
Dibutyl-{3-[4-(6-methyl-imidazo[1,2-a]pyridin-2-yl)-phenoxy]-propyl}-amine
CID 10111190

Frequently Asked Questions

What is the IUPAC name of 4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile?
The IUPAC name of 4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile (CID 163838969) is 4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile.
What is the SMILES notation for 4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile?
The canonical SMILES for 4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile is CC1(COc2ccn3c(-c4ccc(C#N)cc4)cnc3c2)COC1.
What is the InChIKey of 4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile?
The InChIKey is OKFOSVBNHDUKBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c1-19(11-23-12-19)13-24-16-6-7-22-17(10-21-18(22)8-16)15-4-2-14(9-20)3-5-15/h2-8,10H,11-13H2,1H3.
What are the key properties of 4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile?
4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile has a molecular weight of 319.36 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-[(3-methyloxetan-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]benzonitrile is sourced from PubChem (CID 163838969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).