5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine

C19H24N4O — CID 162657443

IUPAC5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine
SMILESCC1(C)Cc2cc(OC3CCNCC3)ccc2-c2ncnc(N)c21
InChIInChI=1S/C19H24N4O/c1-19(2)10-12-9-14(24-13-5-7-21-8-6-13)3-4-15(12)17-16(19)18(20)23-11-22-17/h3-4,9,11,13,21H,5-8,10H2,1-2H3,(H2,20,22,23)
InChIKeyZEANPAFMPLRIQO-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.69
Rot. Bonds2

About 5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine

5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine (PubChem CID 162657443) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine.

Molecular Properties

Compound Name5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine
PubChem CID162657443
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine
SMILESCC1(C)Cc2cc(OC3CCNCC3)ccc2-c2ncnc(N)c21
InChIInChI=1S/C19H24N4O/c1-19(2)10-12-9-14(24-13-5-7-21-8-6-13)3-4-15(12)17-16(19)18(20)23-11-22-17/h3-4,9,11,13,21H,5-8,10H2,1-2H3,(H2,20,22,23)
InChIKeyZEANPAFMPLRIQO-UHFFFAOYSA-N
XLogP2.69
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine?
The IUPAC name of 5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine (CID 162657443) is 5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine.
What is the SMILES notation for 5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine?
The canonical SMILES for 5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine is CC1(C)Cc2cc(OC3CCNCC3)ccc2-c2ncnc(N)c21.
What is the InChIKey of 5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine?
The InChIKey is ZEANPAFMPLRIQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-19(2)10-12-9-14(24-13-5-7-21-8-6-13)3-4-15(12)17-16(19)18(20)23-11-22-17/h3-4,9,11,13,21H,5-8,10H2,1-2H3,(H2,20,22,23).
What are the key properties of 5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine?
5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine has a molecular weight of 324.43 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-8-piperidin-4-yloxy-6H-benzo[h]quinazolin-4-amine is sourced from PubChem (CID 162657443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).