4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline

C18H24N6O — CID 133460856

IUPAC4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline
SMILESCOc1cncc(N2CCN(c3nc(C)nc4c3CCCC4)CC2)n1
InChIInChI=1S/C18H24N6O/c1-13-20-15-6-4-3-5-14(15)18(21-13)24-9-7-23(8-10-24)16-11-19-12-17(22-16)25-2/h11-12H,3-10H2,1-2H3
InChIKeyDNLPELFZIFLBGO-UHFFFAOYSA-N
MW340.43 g/mol
LogP1.79
Rot. Bonds3

About 4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline

4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline (PubChem CID 133460856) has the molecular formula C18H24N6O and a molecular weight of 340.43 g/mol. Its IUPAC name is 4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline.

Molecular Properties

Compound Name4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline
PubChem CID133460856
Molecular FormulaC18H24N6O
Molecular Weight340.43 g/mol
Exact Mass340.20
IUPAC Name4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline
SMILESCOc1cncc(N2CCN(c3nc(C)nc4c3CCCC4)CC2)n1
InChIInChI=1S/C18H24N6O/c1-13-20-15-6-4-3-5-14(15)18(21-13)24-9-7-23(8-10-24)16-11-19-12-17(22-16)25-2/h11-12H,3-10H2,1-2H3
InChIKeyDNLPELFZIFLBGO-UHFFFAOYSA-N
XLogP1.79
TPSA67.27 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline with MolForge

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Related Compounds

4-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline
CID 133460365
2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline;propane
CID 143604667
4-[6-[4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 133461049
N,N-dimethyl-4-[4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperazin-1-yl]pyrimidin-2-amine
CID 133461061
N,N-dimethyl-6-[4-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazin-1-yl]pyrimidin-4-amine
CID 155981005
2-methoxy-6-(4-propan-2-ylpiperazin-1-yl)pyrazine
CID 166710904
4-[4-[3-fluoro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 155974552
2-methyl-4-[4-(trifluoromethyl)piperidin-1-yl]-5,6,7,8-tetrahydroquinazoline
CID 133461386
2-(4-cyclohexylpiperazin-1-yl)-6-methoxypyrazine
CID 171701805
4-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline
CID 133472715
6-methoxy-N-[1-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperidin-4-yl]pyrimidin-4-amine
CID 126888305
[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-[1-(2-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone
CID 86958799

Frequently Asked Questions

What is the IUPAC name of 4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline?
The IUPAC name of 4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline (CID 133460856) is 4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline.
What is the SMILES notation for 4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline?
The canonical SMILES for 4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline is COc1cncc(N2CCN(c3nc(C)nc4c3CCCC4)CC2)n1.
What is the InChIKey of 4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline?
The InChIKey is DNLPELFZIFLBGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O/c1-13-20-15-6-4-3-5-14(15)18(21-13)24-9-7-23(8-10-24)16-11-19-12-17(22-16)25-2/h11-12H,3-10H2,1-2H3.
What are the key properties of 4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline?
4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline has a molecular weight of 340.43 g/mol, XLogP of 1.79, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline is sourced from PubChem (CID 133460856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).