N-benzyl-2-pyridin-2-ylquinazolin-4-amine

C20H16N4 — CID 936435

IUPACN-benzyl-2-pyridin-2-ylquinazolin-4-amine
SMILESc1ccc(CNc2nc(-c3ccccn3)nc3ccccc23)cc1
InChIInChI=1S/C20H16N4/c1-2-8-15(9-3-1)14-22-19-16-10-4-5-11-17(16)23-20(24-19)18-12-6-7-13-21-18/h1-13H,14H2,(H,22,23,24)
InChIKeyLVDCGGJQSCVQAI-UHFFFAOYSA-N
MW312.38 g/mol
LogP4.30
Rot. Bonds4

About N-benzyl-2-pyridin-2-ylquinazolin-4-amine

N-benzyl-2-pyridin-2-ylquinazolin-4-amine (PubChem CID 936435) has the molecular formula C20H16N4 and a molecular weight of 312.38 g/mol. Its IUPAC name is N-benzyl-2-pyridin-2-ylquinazolin-4-amine.

Molecular Properties

Compound NameN-benzyl-2-pyridin-2-ylquinazolin-4-amine
PubChem CID936435
Molecular FormulaC20H16N4
Molecular Weight312.38 g/mol
Exact Mass312.14
IUPAC NameN-benzyl-2-pyridin-2-ylquinazolin-4-amine
SMILESc1ccc(CNc2nc(-c3ccccn3)nc3ccccc23)cc1
InChIInChI=1S/C20H16N4/c1-2-8-15(9-3-1)14-22-19-16-10-4-5-11-17(16)23-20(24-19)18-12-6-7-13-21-18/h1-13H,14H2,(H,22,23,24)
InChIKeyLVDCGGJQSCVQAI-UHFFFAOYSA-N
XLogP4.30
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.38
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Quipazine
CID 5011
Quinazoline
CID 9210
4-Aminoquinazoline
CID 84759
Spautin-1
CID 51037431
Ngd-8243
CID 11247522
Pd 158780
CID 4707
N-Benzyl-2-phenyl-4-quinazolinamine
CID 780643
N2,N4-Dibenzylquinazoline-2,4-diamine
CID 676352
CR-4056
CID 24898732
5-(5-Phenyl-4-(pyridin-2-ylmethylamino)quinazolin-2-yl)pyridine-3-sulfonamide
CID 51030730
(alphaS)-7-Fluoro-alpha-methyl-N-9H-purin-6-yl-2-(2-pyridinyl)-3-quinolinemethanamine
CID 68947304
N6,N6-dimethyl-N4-[1-(phenylmethyl)-5-indazolyl]pyrido[3,4-d]pyrimidine-4,6-diamine
CID 6603857

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-pyridin-2-ylquinazolin-4-amine?
The IUPAC name of N-benzyl-2-pyridin-2-ylquinazolin-4-amine (CID 936435) is N-benzyl-2-pyridin-2-ylquinazolin-4-amine.
What is the SMILES notation for N-benzyl-2-pyridin-2-ylquinazolin-4-amine?
The canonical SMILES for N-benzyl-2-pyridin-2-ylquinazolin-4-amine is c1ccc(CNc2nc(-c3ccccn3)nc3ccccc23)cc1.
What is the InChIKey of N-benzyl-2-pyridin-2-ylquinazolin-4-amine?
The InChIKey is LVDCGGJQSCVQAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4/c1-2-8-15(9-3-1)14-22-19-16-10-4-5-11-17(16)23-20(24-19)18-12-6-7-13-21-18/h1-13H,14H2,(H,22,23,24).
What are the key properties of N-benzyl-2-pyridin-2-ylquinazolin-4-amine?
N-benzyl-2-pyridin-2-ylquinazolin-4-amine has a molecular weight of 312.38 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-pyridin-2-ylquinazolin-4-amine is sourced from PubChem (CID 936435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).