1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone

C17H15N3O — CID 167853594

IUPAC1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone
SMILESCc1nc(C(=O)N2Cc3ccccc3C2)c2ccccn12
InChIInChI=1S/C17H15N3O/c1-12-18-16(15-8-4-5-9-20(12)15)17(21)19-10-13-6-2-3-7-14(13)11-19/h2-9H,10-11H2,1H3
InChIKeyQTMKBLVCMBPFNK-UHFFFAOYSA-N
MW277.33 g/mol
LogP2.80
Rot. Bonds1

About 1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone

1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone (PubChem CID 167853594) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone.

Molecular Properties

Compound Name1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone
PubChem CID167853594
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone
SMILESCc1nc(C(=O)N2Cc3ccccc3C2)c2ccccn12
InChIInChI=1S/C17H15N3O/c1-12-18-16(15-8-4-5-9-20(12)15)17(21)19-10-13-6-2-3-7-14(13)11-19/h2-9H,10-11H2,1H3
InChIKeyQTMKBLVCMBPFNK-UHFFFAOYSA-N
XLogP2.80
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone?
The IUPAC name of 1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone (CID 167853594) is 1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone.
What is the SMILES notation for 1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone?
The canonical SMILES for 1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone is Cc1nc(C(=O)N2Cc3ccccc3C2)c2ccccn12.
What is the InChIKey of 1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone?
The InChIKey is QTMKBLVCMBPFNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-12-18-16(15-8-4-5-9-20(12)15)17(21)19-10-13-6-2-3-7-14(13)11-19/h2-9H,10-11H2,1H3.
What are the key properties of 1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone?
1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone has a molecular weight of 277.33 g/mol, XLogP of 2.80, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone is sourced from PubChem (CID 167853594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).