6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine

C14H19N5 — CID 158357894

IUPAC6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine
SMILESCc1cc2nc(N3CCNCC3)nc(N)c2cc1C
InChIInChI=1S/C14H19N5/c1-9-7-11-12(8-10(9)2)17-14(18-13(11)15)19-5-3-16-4-6-19/h7-8,16H,3-6H2,1-2H3,(H2,15,17,18)
InChIKeyRDYHCHLITQNGNZ-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.24
Rot. Bonds1

About 6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine

6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine (PubChem CID 158357894) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is 6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine.

Molecular Properties

Compound Name6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine
PubChem CID158357894
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC Name6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine
SMILESCc1cc2nc(N3CCNCC3)nc(N)c2cc1C
InChIInChI=1S/C14H19N5/c1-9-7-11-12(8-10(9)2)17-14(18-13(11)15)19-5-3-16-4-6-19/h7-8,16H,3-6H2,1-2H3,(H2,15,17,18)
InChIKeyRDYHCHLITQNGNZ-UHFFFAOYSA-N
XLogP1.24
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine?
The IUPAC name of 6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine (CID 158357894) is 6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine.
What is the SMILES notation for 6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine?
The canonical SMILES for 6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine is Cc1cc2nc(N3CCNCC3)nc(N)c2cc1C.
What is the InChIKey of 6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine?
The InChIKey is RDYHCHLITQNGNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-9-7-11-12(8-10(9)2)17-14(18-13(11)15)19-5-3-16-4-6-19/h7-8,16H,3-6H2,1-2H3,(H2,15,17,18).
What are the key properties of 6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine?
6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine has a molecular weight of 257.34 g/mol, XLogP of 1.24, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine is sourced from PubChem (CID 158357894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).