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

C19H24N4 — CID 162647462

IUPAC5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine
SMILESCC1(C)Cc2cc(C3CCNCC3)ccc2-c2ncnc(N)c21
InChIInChI=1S/C19H24N4/c1-19(2)10-14-9-13(12-5-7-21-8-6-12)3-4-15(14)17-16(19)18(20)23-11-22-17/h3-4,9,11-12,21H,5-8,10H2,1-2H3,(H2,20,22,23)
InChIKeyLWYWMZFSQGNMEN-UHFFFAOYSA-N
MW308.43 g/mol
LogP3.03
Rot. Bonds1

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

5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine (PubChem CID 162647462) has the molecular formula C19H24N4 and a molecular weight of 308.43 g/mol. Its IUPAC name is 5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine.

Molecular Properties

Compound Name5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine
PubChem CID162647462
Molecular FormulaC19H24N4
Molecular Weight308.43 g/mol
Exact Mass308.20
IUPAC Name5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine
SMILESCC1(C)Cc2cc(C3CCNCC3)ccc2-c2ncnc(N)c21
InChIInChI=1S/C19H24N4/c1-19(2)10-14-9-13(12-5-7-21-8-6-12)3-4-15(14)17-16(19)18(20)23-11-22-17/h3-4,9,11-12,21H,5-8,10H2,1-2H3,(H2,20,22,23)
InChIKeyLWYWMZFSQGNMEN-UHFFFAOYSA-N
XLogP3.03
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine?
The IUPAC name of 5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine (CID 162647462) is 5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine.
What is the SMILES notation for 5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine?
The canonical SMILES for 5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine is CC1(C)Cc2cc(C3CCNCC3)ccc2-c2ncnc(N)c21.
What is the InChIKey of 5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine?
The InChIKey is LWYWMZFSQGNMEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4/c1-19(2)10-14-9-13(12-5-7-21-8-6-12)3-4-15(14)17-16(19)18(20)23-11-22-17/h3-4,9,11-12,21H,5-8,10H2,1-2H3,(H2,20,22,23).
What are the key properties of 5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine?
5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine has a molecular weight of 308.43 g/mol, XLogP of 3.03, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-8-piperidin-4-yl-6H-benzo[h]quinazolin-4-amine is sourced from PubChem (CID 162647462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).