4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine

C15H20N4 — CID 65337141

IUPAC4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine
SMILESCC1CC(C)CN(c2ncnc3cc(N)ccc23)C1
InChIInChI=1S/C15H20N4/c1-10-5-11(2)8-19(7-10)15-13-4-3-12(16)6-14(13)17-9-18-15/h3-4,6,9-11H,5,7-8,16H2,1-2H3
InChIKeyDTIMMPPPMPEXST-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.69
Rot. Bonds1

About 4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine

4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine (PubChem CID 65337141) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine.

Molecular Properties

Compound Name4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine
PubChem CID65337141
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine
SMILESCC1CC(C)CN(c2ncnc3cc(N)ccc23)C1
InChIInChI=1S/C15H20N4/c1-10-5-11(2)8-19(7-10)15-13-4-3-12(16)6-14(13)17-9-18-15/h3-4,6,9-11H,5,7-8,16H2,1-2H3
InChIKeyDTIMMPPPMPEXST-UHFFFAOYSA-N
XLogP2.69
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine?
The IUPAC name of 4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine (CID 65337141) is 4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine.
What is the SMILES notation for 4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine?
The canonical SMILES for 4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine is CC1CC(C)CN(c2ncnc3cc(N)ccc23)C1.
What is the InChIKey of 4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine?
The InChIKey is DTIMMPPPMPEXST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-10-5-11(2)8-19(7-10)15-13-4-3-12(16)6-14(13)17-9-18-15/h3-4,6,9-11H,5,7-8,16H2,1-2H3.
What are the key properties of 4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine?
4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine has a molecular weight of 256.35 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine is sourced from PubChem (CID 65337141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).