2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine

C27H21N7 — CID 121377359

IUPAC2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine
SMILESc1ccc(C(CNc2nc(-c3cnc4nccn4c3)nc3ccccc23)c2ccncc2)cc1
InChIInChI=1S/C27H21N7/c1-2-6-19(7-3-1)23(20-10-12-28-13-11-20)17-30-26-22-8-4-5-9-24(22)32-25(33-26)21-16-31-27-29-14-15-34(27)18-21/h1-16,18,23H,17H2,(H,30,32,33)
InChIKeyLIGDDXJDAPAZBW-UHFFFAOYSA-N
MW443.51 g/mol
LogP4.98
Rot. Bonds6

About 2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine

2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine (PubChem CID 121377359) has the molecular formula C27H21N7 and a molecular weight of 443.51 g/mol. Its IUPAC name is 2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine.

Molecular Properties

Compound Name2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine
PubChem CID121377359
Molecular FormulaC27H21N7
Molecular Weight443.51 g/mol
Exact Mass443.19
IUPAC Name2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine
SMILESc1ccc(C(CNc2nc(-c3cnc4nccn4c3)nc3ccccc23)c2ccncc2)cc1
InChIInChI=1S/C27H21N7/c1-2-6-19(7-3-1)23(20-10-12-28-13-11-20)17-30-26-22-8-4-5-9-24(22)32-25(33-26)21-16-31-27-29-14-15-34(27)18-21/h1-16,18,23H,17H2,(H,30,32,33)
InChIKeyLIGDDXJDAPAZBW-UHFFFAOYSA-N
XLogP4.98
TPSA80.89 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.51
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2,2-diphenylethyl)-2-pyridin-4-ylquinazolin-4-amine
CID 121377208
N-(2,2-diphenylethyl)-2-pyrazolo[1,5-a]pyrimidin-6-ylquinazolin-4-amine
CID 121377267
N-[(1S)-2-[(2-imidazo[1,2-a]pyridin-6-ylquinazolin-4-yl)amino]-1-phenylethyl]benzamide
CID 121377274
N-(2,2-difluoroethyl)-2-pyridin-4-ylquinazolin-4-amine
CID 166217645
N-(2,2-diphenylethyl)-2-(1H-indazol-6-yl)quinazolin-4-amine
CID 121377327
(2S)-3-[(2-pyridin-4-ylquinazolin-4-yl)amino]propane-1,2-diol
CID 11150616
N-(2,2-diphenylethyl)-2-quinolin-8-ylquinazolin-4-amine
CID 121377287
N-[4-[4-[(2-phenyl-2-pyridin-3-ylethyl)amino]quinazolin-2-yl]phenyl]methanesulfonamide
CID 121378099
N-(2,2-diphenylethyl)-2-(2-methylisoindol-4-yl)quinazolin-4-amine
CID 121388227
2-[2-(dimethylamino)pyrimidin-5-yl]-N-[2-[6-[2-(dimethylamino)pyrimidin-5-yl]-2-pyridinyl]-2-phenylethyl]quinazolin-4-amine
CID 121377264
N-(2,2-diphenylethyl)-2-imidazo[1,2-a]pyridin-6-yl-7-(3-morpholin-4-ylpropoxy)quinazolin-4-amine;hydrochloride
CID 121377347
N-[4-[4-[(2-phenyl-2-pyrimidin-2-ylethyl)amino]quinazolin-2-yl]phenyl]methanesulfonamide
CID 121378089

Frequently Asked Questions

What is the IUPAC name of 2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine?
The IUPAC name of 2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine (CID 121377359) is 2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine.
What is the SMILES notation for 2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine?
The canonical SMILES for 2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine is c1ccc(C(CNc2nc(-c3cnc4nccn4c3)nc3ccccc23)c2ccncc2)cc1.
What is the InChIKey of 2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine?
The InChIKey is LIGDDXJDAPAZBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H21N7/c1-2-6-19(7-3-1)23(20-10-12-28-13-11-20)17-30-26-22-8-4-5-9-24(22)32-25(33-26)21-16-31-27-29-14-15-34(27)18-21/h1-16,18,23H,17H2,(H,30,32,33).
What are the key properties of 2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine?
2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine has a molecular weight of 443.51 g/mol, XLogP of 4.98, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[1,2-a]pyrimidin-6-yl-N-(2-phenyl-2-pyridin-4-ylethyl)quinazolin-4-amine is sourced from PubChem (CID 121377359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).