4-cyclohexyl-6,7-dimethoxyquinazoline

C16H20N2O2 — CID 67650996

IUPAC4-cyclohexyl-6,7-dimethoxyquinazoline
SMILESCOc1cc2ncnc(C3CCCCC3)c2cc1OC
InChIInChI=1S/C16H20N2O2/c1-19-14-8-12-13(9-15(14)20-2)17-10-18-16(12)11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3
InChIKeyJIBBPUJCWDPTFW-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.69
Rot. Bonds3

About 4-cyclohexyl-6,7-dimethoxyquinazoline

4-cyclohexyl-6,7-dimethoxyquinazoline (PubChem CID 67650996) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-cyclohexyl-6,7-dimethoxyquinazoline.

Molecular Properties

Compound Name4-cyclohexyl-6,7-dimethoxyquinazoline
PubChem CID67650996
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name4-cyclohexyl-6,7-dimethoxyquinazoline
SMILESCOc1cc2ncnc(C3CCCCC3)c2cc1OC
InChIInChI=1S/C16H20N2O2/c1-19-14-8-12-13(9-15(14)20-2)17-10-18-16(12)11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3
InChIKeyJIBBPUJCWDPTFW-UHFFFAOYSA-N
XLogP3.69
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(6,7-dimethoxyquinazolin-4-yl)piperidin-1-yl]ethylphosphonous acid
CID 154672995
1-cyclohexyl-6,7-dimethoxyisoquinoline
CID 70208603
[4-(6,7-dimethoxyquinazolin-4-yl)piperidin-1-yl]methyl dihydrogen phosphate
CID 162511263
[4-(6,7-dimethoxyquinazolin-4-yl)cyclohexyl] ethyl hydrogen phosphate
CID 175544920
N-[4-(6,7-dimethoxyquinazolin-4-yl)piperidin-1-yl]-N-phenylformamide
CID 174565011
1-[2-(6-methoxy-4-piperidin-4-ylquinazolin-7-yl)oxyethyl]pyrrolidin-2-one
CID 141169592
1,3-dicyclohexylurea;6,7-dimethoxyquinazolin-4-amine
CID 174731053
6,7-dimethoxy-4-methylquinazoline
CID 4319422
N-cyclohexyl-6,7-dimethoxy-N-phenylquinazolin-4-amine
CID 18770836
4-chloro-7-(3-cyclohexylpropoxy)-6-methoxyquinazoline
CID 10980561
4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 58770728
4-(azepan-4-yl)-7-methoxyquinazoline
CID 162748452

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-6,7-dimethoxyquinazoline?
The IUPAC name of 4-cyclohexyl-6,7-dimethoxyquinazoline (CID 67650996) is 4-cyclohexyl-6,7-dimethoxyquinazoline.
What is the SMILES notation for 4-cyclohexyl-6,7-dimethoxyquinazoline?
The canonical SMILES for 4-cyclohexyl-6,7-dimethoxyquinazoline is COc1cc2ncnc(C3CCCCC3)c2cc1OC.
What is the InChIKey of 4-cyclohexyl-6,7-dimethoxyquinazoline?
The InChIKey is JIBBPUJCWDPTFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-19-14-8-12-13(9-15(14)20-2)17-10-18-16(12)11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3.
What are the key properties of 4-cyclohexyl-6,7-dimethoxyquinazoline?
4-cyclohexyl-6,7-dimethoxyquinazoline has a molecular weight of 272.35 g/mol, XLogP of 3.69, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-6,7-dimethoxyquinazoline is sourced from PubChem (CID 67650996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).