7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine

C17H23N3 — CID 70306977

IUPAC7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
SMILESCc1cccc(CN2Cc3cncn3C(C(C)C)C2)c1
InChIInChI=1S/C17H23N3/c1-13(2)17-11-19(10-16-8-18-12-20(16)17)9-15-6-4-5-14(3)7-15/h4-8,12-13,17H,9-11H2,1-3H3
InChIKeyXTUXVVMFMXUNAN-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.40
Rot. Bonds3

About 7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine

7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine (PubChem CID 70306977) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
PubChem CID70306977
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
SMILESCc1cccc(CN2Cc3cncn3C(C(C)C)C2)c1
InChIInChI=1S/C17H23N3/c1-13(2)17-11-19(10-16-8-18-12-20(16)17)9-15-6-4-5-14(3)7-15/h4-8,12-13,17H,9-11H2,1-3H3
InChIKeyXTUXVVMFMXUNAN-UHFFFAOYSA-N
XLogP3.40
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 153136361
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CID 97484377
1-[(3-methylphenyl)methyl]-4-(2-methylpropyl)piperazine
CID 45366485
3-[(3-methylphenyl)methyl]-3-azabicyclo[3.1.0]hexane
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7-[(3-fluorophenyl)methyl]-5-propan-2-yl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
CID 24772323
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Frequently Asked Questions

What is the IUPAC name of 7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
The IUPAC name of 7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine (CID 70306977) is 7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine.
What is the SMILES notation for 7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
The canonical SMILES for 7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine is Cc1cccc(CN2Cc3cncn3C(C(C)C)C2)c1.
What is the InChIKey of 7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
The InChIKey is XTUXVVMFMXUNAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-13(2)17-11-19(10-16-8-18-12-20(16)17)9-15-6-4-5-14(3)7-15/h4-8,12-13,17H,9-11H2,1-3H3.
What are the key properties of 7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine has a molecular weight of 269.39 g/mol, XLogP of 3.40, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(3-methylphenyl)methyl]-5-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine is sourced from PubChem (CID 70306977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).