(3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone

C20H27N3O2 — CID 110631205

IUPAC(3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone
SMILESCC1COCC(C)N1C(=O)c1nc(C2CCCCC2)n2ccccc12
InChIInChI=1S/C20H27N3O2/c1-14-12-25-13-15(2)23(14)20(24)18-17-10-6-7-11-22(17)19(21-18)16-8-4-3-5-9-16/h6-7,10-11,14-16H,3-5,8-9,12-13H2,1-2H3
InChIKeyURUVUBIMQARUIA-UHFFFAOYSA-N
MW341.46 g/mol
LogP3.63
Rot. Bonds2

About (3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone

(3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone (PubChem CID 110631205) has the molecular formula C20H27N3O2 and a molecular weight of 341.46 g/mol. Its IUPAC name is (3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone
PubChem CID110631205
Molecular FormulaC20H27N3O2
Molecular Weight341.46 g/mol
Exact Mass341.21
IUPAC Name(3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone
SMILESCC1COCC(C)N1C(=O)c1nc(C2CCCCC2)n2ccccc12
InChIInChI=1S/C20H27N3O2/c1-14-12-25-13-15(2)23(14)20(24)18-17-10-6-7-11-22(17)19(21-18)16-8-4-3-5-9-16/h6-7,10-11,14-16H,3-5,8-9,12-13H2,1-2H3
InChIKeyURUVUBIMQARUIA-UHFFFAOYSA-N
XLogP3.63
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone?
The IUPAC name of (3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone (CID 110631205) is (3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone.
What is the SMILES notation for (3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone?
The canonical SMILES for (3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone is CC1COCC(C)N1C(=O)c1nc(C2CCCCC2)n2ccccc12.
What is the InChIKey of (3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone?
The InChIKey is URUVUBIMQARUIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c1-14-12-25-13-15(2)23(14)20(24)18-17-10-6-7-11-22(17)19(21-18)16-8-4-3-5-9-16/h6-7,10-11,14-16H,3-5,8-9,12-13H2,1-2H3.
What are the key properties of (3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone?
(3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone has a molecular weight of 341.46 g/mol, XLogP of 3.63, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclohexylimidazo[1,5-a]pyridin-1-yl)-(3,5-dimethylmorpholin-4-yl)methanone is sourced from PubChem (CID 110631205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).