6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine

C21H19N5 — CID 155340173

IUPAC6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine
SMILESCc1ccc(-c2ccc3ncnc(NCc4ccc(C)nc4)c3c2)nc1
InChIInChI=1S/C21H19N5/c1-14-3-7-19(23-10-14)17-6-8-20-18(9-17)21(26-13-25-20)24-12-16-5-4-15(2)22-11-16/h3-11,13H,12H2,1-2H3,(H,24,25,26)
InChIKeyURVRSEJOBPXIRQ-UHFFFAOYSA-N
MW341.42 g/mol
LogP4.32
Rot. Bonds4

About 6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine

6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine (PubChem CID 155340173) has the molecular formula C21H19N5 and a molecular weight of 341.42 g/mol. Its IUPAC name is 6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine.

Molecular Properties

Compound Name6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine
PubChem CID155340173
Molecular FormulaC21H19N5
Molecular Weight341.42 g/mol
Exact Mass341.16
IUPAC Name6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine
SMILESCc1ccc(-c2ccc3ncnc(NCc4ccc(C)nc4)c3c2)nc1
InChIInChI=1S/C21H19N5/c1-14-3-7-19(23-10-14)17-6-8-20-18(9-17)21(26-13-25-20)24-12-16-5-4-15(2)22-11-16/h3-11,13H,12H2,1-2H3,(H,24,25,26)
InChIKeyURVRSEJOBPXIRQ-UHFFFAOYSA-N
XLogP4.32
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine?
The IUPAC name of 6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine (CID 155340173) is 6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine.
What is the SMILES notation for 6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine?
The canonical SMILES for 6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine is Cc1ccc(-c2ccc3ncnc(NCc4ccc(C)nc4)c3c2)nc1.
What is the InChIKey of 6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine?
The InChIKey is URVRSEJOBPXIRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5/c1-14-3-7-19(23-10-14)17-6-8-20-18(9-17)21(26-13-25-20)24-12-16-5-4-15(2)22-11-16/h3-11,13H,12H2,1-2H3,(H,24,25,26).
What are the key properties of 6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine?
6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine has a molecular weight of 341.42 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methyl-2-pyridinyl)-N-[(6-methyl-3-pyridinyl)methyl]quinazolin-4-amine is sourced from PubChem (CID 155340173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).