8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine

C24H20F2N4O — CID 175011011

IUPAC8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine
SMILESFc1cccc(F)c1-c1cccc2cnc(Nc3ccc(C4CNCCO4)cc3)nc12
InChIInChI=1S/C24H20F2N4O/c25-19-5-2-6-20(26)22(19)18-4-1-3-16-13-28-24(30-23(16)18)29-17-9-7-15(8-10-17)21-14-27-11-12-31-21/h1-10,13,21,27H,11-12,14H2,(H,28,29,30)
InChIKeyNQHVDRXXQJBCBO-UHFFFAOYSA-N
MW418.45 g/mol
LogP4.98
Rot. Bonds4

About 8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine

8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine (PubChem CID 175011011) has the molecular formula C24H20F2N4O and a molecular weight of 418.45 g/mol. Its IUPAC name is 8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine.

Molecular Properties

Compound Name8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine
PubChem CID175011011
Molecular FormulaC24H20F2N4O
Molecular Weight418.45 g/mol
Exact Mass418.16
IUPAC Name8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine
SMILESFc1cccc(F)c1-c1cccc2cnc(Nc3ccc(C4CNCCO4)cc3)nc12
InChIInChI=1S/C24H20F2N4O/c25-19-5-2-6-20(26)22(19)18-4-1-3-16-13-28-24(30-23(16)18)29-17-9-7-15(8-10-17)21-14-27-11-12-31-21/h1-10,13,21,27H,11-12,14H2,(H,28,29,30)
InChIKeyNQHVDRXXQJBCBO-UHFFFAOYSA-N
XLogP4.98
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.45
LogP ≤ 54.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-cyclopropyl-5-fluoro-4-N-(4-morpholin-2-ylphenyl)pyrimidine-2,4-diamine
CID 174489062
5-fluoro-N-[4-[(2S)-morpholin-2-yl]phenyl]pyrimidin-2-amine;5-methoxy-N-[4-[(2S)-morpholin-2-yl]phenyl]pyrimidin-2-amine
CID 158357613
N-[3-[7-chloro-2-(4-morpholin-2-ylanilino)quinazolin-8-yl]phenyl]prop-2-enamide
CID 175012181
3,5-difluoro-4-[2-(4-methylanilino)quinazolin-8-yl]benzaldehyde
CID 139376441
8-[5-[2-(dimethylamino)ethoxy]-2-fluorophenyl]-2-N-(4-morpholin-2-ylphenyl)quinazoline-2,4-diamine
CID 175013761
N-[2-[7-fluoro-2-[(6-morpholin-2-yl-3-pyridinyl)amino]quinazolin-8-yl]-4-pyridinyl]prop-2-enamide
CID 175012176
5-chloro-N-[4-[(2S)-morpholin-2-yl]phenyl]pyrimidin-2-amine;5-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrimidin-2-amine;5-ethoxy-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrimidin-2-amine
CID 158155601
8-[5-(1-morpholin-2-ylethoxy)-2-pyridinyl]-N-(4-piperazin-1-ylphenyl)quinazolin-2-amine
CID 175011381
5-bromo-N-[2-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyrimidin-2-amine;5-bromo-N-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]pyrimidin-2-amine
CID 159579363
6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine
CID 86766846
4-chloro-2-fluoro-N-[4-[(2S)-morpholin-2-yl]phenyl]aniline;N-(4-chlorophenyl)-4-morpholin-2-ylaniline;N-[4-[(2S)-morpholin-2-yl]phenyl]naphthalen-2-amine
CID 159618728
8-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(2-morpholin-2-yl-3-pyridinyl)quinazolin-2-amine
CID 175011008

Frequently Asked Questions

What is the IUPAC name of 8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine?
The IUPAC name of 8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine (CID 175011011) is 8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine.
What is the SMILES notation for 8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine?
The canonical SMILES for 8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine is Fc1cccc(F)c1-c1cccc2cnc(Nc3ccc(C4CNCCO4)cc3)nc12.
What is the InChIKey of 8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine?
The InChIKey is NQHVDRXXQJBCBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20F2N4O/c25-19-5-2-6-20(26)22(19)18-4-1-3-16-13-28-24(30-23(16)18)29-17-9-7-15(8-10-17)21-14-27-11-12-31-21/h1-10,13,21,27H,11-12,14H2,(H,28,29,30).
What are the key properties of 8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine?
8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine has a molecular weight of 418.45 g/mol, XLogP of 4.98, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,6-difluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine is sourced from PubChem (CID 175011011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).