(3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone

C19H24N4O — CID 154736798

IUPAC(3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone
SMILESCc1ncc2n1CCC(C(=O)N1CC(C)(C)C1c1ccncc1)C2
InChIInChI=1S/C19H24N4O/c1-13-21-11-16-10-15(6-9-22(13)16)18(24)23-12-19(2,3)17(23)14-4-7-20-8-5-14/h4-5,7-8,11,15,17H,6,9-10,12H2,1-3H3
InChIKeyLUISJSGZEZVGRC-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.76
Rot. Bonds2

About (3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone

(3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone (PubChem CID 154736798) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is (3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone.

Molecular Properties

Compound Name(3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone
PubChem CID154736798
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name(3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone
SMILESCc1ncc2n1CCC(C(=O)N1CC(C)(C)C1c1ccncc1)C2
InChIInChI=1S/C19H24N4O/c1-13-21-11-16-10-15(6-9-22(13)16)18(24)23-12-19(2,3)17(23)14-4-7-20-8-5-14/h4-5,7-8,11,15,17H,6,9-10,12H2,1-3H3
InChIKeyLUISJSGZEZVGRC-UHFFFAOYSA-N
XLogP2.76
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone?
The IUPAC name of (3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone (CID 154736798) is (3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone.
What is the SMILES notation for (3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone?
The canonical SMILES for (3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone is Cc1ncc2n1CCC(C(=O)N1CC(C)(C)C1c1ccncc1)C2.
What is the InChIKey of (3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone?
The InChIKey is LUISJSGZEZVGRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-13-21-11-16-10-15(6-9-22(13)16)18(24)23-12-19(2,3)17(23)14-4-7-20-8-5-14/h4-5,7-8,11,15,17H,6,9-10,12H2,1-3H3.
What are the key properties of (3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone?
(3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone has a molecular weight of 324.43 g/mol, XLogP of 2.76, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-dimethyl-2-pyridin-4-ylazetidin-1-yl)-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone is sourced from PubChem (CID 154736798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).