N-benzyl-2-imidazol-1-ylquinazolin-4-amine

C18H15N5 — CID 10266864

IUPACN-benzyl-2-imidazol-1-ylquinazolin-4-amine
SMILESc1ccc(CNc2nc(-n3ccnc3)nc3ccccc23)cc1
InChIInChI=1S/C18H15N5/c1-2-6-14(7-3-1)12-20-17-15-8-4-5-9-16(15)21-18(22-17)23-11-10-19-13-23/h1-11,13H,12H2,(H,20,21,22)
InChIKeyFNTPEBIGZTYDQK-UHFFFAOYSA-N
MW301.35 g/mol
LogP3.43
Rot. Bonds4

About N-benzyl-2-imidazol-1-ylquinazolin-4-amine

N-benzyl-2-imidazol-1-ylquinazolin-4-amine (PubChem CID 10266864) has the molecular formula C18H15N5 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-benzyl-2-imidazol-1-ylquinazolin-4-amine.

Molecular Properties

Compound NameN-benzyl-2-imidazol-1-ylquinazolin-4-amine
PubChem CID10266864
Molecular FormulaC18H15N5
Molecular Weight301.35 g/mol
Exact Mass301.13
IUPAC NameN-benzyl-2-imidazol-1-ylquinazolin-4-amine
SMILESc1ccc(CNc2nc(-n3ccnc3)nc3ccccc23)cc1
InChIInChI=1S/C18H15N5/c1-2-6-14(7-3-1)12-20-17-15-8-4-5-9-16(15)21-18(22-17)23-11-10-19-13-23/h1-11,13H,12H2,(H,20,21,22)
InChIKeyFNTPEBIGZTYDQK-UHFFFAOYSA-N
XLogP3.43
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-imidazol-1-ylquinazolin-4-amine?
The IUPAC name of N-benzyl-2-imidazol-1-ylquinazolin-4-amine (CID 10266864) is N-benzyl-2-imidazol-1-ylquinazolin-4-amine.
What is the SMILES notation for N-benzyl-2-imidazol-1-ylquinazolin-4-amine?
The canonical SMILES for N-benzyl-2-imidazol-1-ylquinazolin-4-amine is c1ccc(CNc2nc(-n3ccnc3)nc3ccccc23)cc1.
What is the InChIKey of N-benzyl-2-imidazol-1-ylquinazolin-4-amine?
The InChIKey is FNTPEBIGZTYDQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5/c1-2-6-14(7-3-1)12-20-17-15-8-4-5-9-16(15)21-18(22-17)23-11-10-19-13-23/h1-11,13H,12H2,(H,20,21,22).
What are the key properties of N-benzyl-2-imidazol-1-ylquinazolin-4-amine?
N-benzyl-2-imidazol-1-ylquinazolin-4-amine has a molecular weight of 301.35 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-imidazol-1-ylquinazolin-4-amine is sourced from PubChem (CID 10266864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).