1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol

C22H25N3O3 — CID 11581681

IUPAC1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol
SMILESCCOc1cc2c(N3CC(O)CC(c4ccccc4)C3)ncnc2cc1OC
InChIInChI=1S/C22H25N3O3/c1-3-28-21-10-18-19(11-20(21)27-2)23-14-24-22(18)25-12-16(9-17(26)13-25)15-7-5-4-6-8-15/h4-8,10-11,14,16-17,26H,3,9,12-13H2,1-2H3
InChIKeyOVHXKVVVLJSDKP-UHFFFAOYSA-N
MW379.46 g/mol
LogP3.39
Rot. Bonds5

About 1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol

1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol (PubChem CID 11581681) has the molecular formula C22H25N3O3 and a molecular weight of 379.46 g/mol. Its IUPAC name is 1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol.

Molecular Properties

Compound Name1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol
PubChem CID11581681
Molecular FormulaC22H25N3O3
Molecular Weight379.46 g/mol
Exact Mass379.19
IUPAC Name1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol
SMILESCCOc1cc2c(N3CC(O)CC(c4ccccc4)C3)ncnc2cc1OC
InChIInChI=1S/C22H25N3O3/c1-3-28-21-10-18-19(11-20(21)27-2)23-14-24-22(18)25-12-16(9-17(26)13-25)15-7-5-4-6-8-15/h4-8,10-11,14,16-17,26H,3,9,12-13H2,1-2H3
InChIKeyOVHXKVVVLJSDKP-UHFFFAOYSA-N
XLogP3.39
TPSA67.71 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-methoxy-4-(3-phenylpiperidin-1-yl)-6-propoxyquinazoline
CID 11545321
(3R,4S)-1-(6,7-dimethoxyquinazolin-4-yl)-3-phenylpiperidin-4-ol
CID 69368621
4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-ethoxy-7-methoxyquinazoline
CID 11537337
6,7-dimethoxy-4-[3-(4-methoxyphenyl)-5-propoxypiperidin-1-yl]quinazoline
CID 58592926
1-(6,7-dimethoxyquinazolin-4-yl)pyrrolidin-3-ol
CID 21487876
4-(6-ethoxy-7-methoxyquinazolin-4-yl)piperazine-1-carboxylic acid
CID 22707631
4-(3,6-diazabicyclo[3.2.1]octan-3-yl)-6,7-dimethoxyquinazoline
CID 156824030
3-[1-(6,7-dimethoxyquinazolin-4-yl)azetidin-3-yl]propanoic acid
CID 163274731
4-[4-(7-ethoxy-6-methoxyquinazolin-4-yl)piperazin-1-yl]benzonitrile
CID 91313177
4-benzyl-1-(6,7-dimethoxyquinazolin-4-yl)-N,N-dimethylpyrrolidin-3-amine
CID 11654032
4-(6-methoxy-7-phenylmethoxyquinazolin-4-yl)piperazine-1-carboxylic acid
CID 22707591
tert-butyl 4-(6-ethoxy-7-methoxyquinazolin-4-yl)piperazine-1-carboxylate
CID 11429163

Frequently Asked Questions

What is the IUPAC name of 1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol?
The IUPAC name of 1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol (CID 11581681) is 1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol.
What is the SMILES notation for 1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol?
The canonical SMILES for 1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol is CCOc1cc2c(N3CC(O)CC(c4ccccc4)C3)ncnc2cc1OC.
What is the InChIKey of 1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol?
The InChIKey is OVHXKVVVLJSDKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O3/c1-3-28-21-10-18-19(11-20(21)27-2)23-14-24-22(18)25-12-16(9-17(26)13-25)15-7-5-4-6-8-15/h4-8,10-11,14,16-17,26H,3,9,12-13H2,1-2H3.
What are the key properties of 1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol?
1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol has a molecular weight of 379.46 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethoxy-7-methoxyquinazolin-4-yl)-5-phenylpiperidin-3-ol is sourced from PubChem (CID 11581681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).