2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine

C23H19ClN4O — CID 133289876

IUPAC2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine
SMILESClc1ccccc1C1CN(c2nc(-c3cccnc3)nc3ccccc23)CCO1
InChIInChI=1S/C23H19ClN4O/c24-19-9-3-1-7-17(19)21-15-28(12-13-29-21)23-18-8-2-4-10-20(18)26-22(27-23)16-6-5-11-25-14-16/h1-11,14,21H,12-13,15H2
InChIKeyBWTUMUUZJNRMIG-UHFFFAOYSA-N
MW402.89 g/mol
LogP4.92
Rot. Bonds3

About 2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine

2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine (PubChem CID 133289876) has the molecular formula C23H19ClN4O and a molecular weight of 402.89 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine
PubChem CID133289876
Molecular FormulaC23H19ClN4O
Molecular Weight402.89 g/mol
Exact Mass402.12
IUPAC Name2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine
SMILESClc1ccccc1C1CN(c2nc(-c3cccnc3)nc3ccccc23)CCO1
InChIInChI=1S/C23H19ClN4O/c24-19-9-3-1-7-17(19)21-15-28(12-13-29-21)23-18-8-2-4-10-20(18)26-22(27-23)16-6-5-11-25-14-16/h1-11,14,21H,12-13,15H2
InChIKeyBWTUMUUZJNRMIG-UHFFFAOYSA-N
XLogP4.92
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.89
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-4-(1-methyl-6-pyridin-3-ylpyrazolo[5,4-d]pyrimidin-4-yl)-2-phenylmorpholine
CID 95709255
4-(3-phenoxypyrrolidin-1-yl)-2-pyridin-3-ylquinazoline
CID 137470060
2-pyridin-3-yl-4-[(3S)-3-(trifluoromethyl)piperidin-1-yl]quinazoline
CID 2540547
4-(1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-2-pyridin-3-ylquinazoline
CID 133322897
4-(2-pyridin-3-ylquinazolin-4-yl)-1,4-thiazinane 1,1-dioxide
CID 133287442
N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine
CID 133363141
3-phenyl-5-[1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-4-yl]-1,2,4-oxadiazole
CID 133299396
phenyl-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-yl]methanone
CID 2480686
2-(2-chlorophenyl)-4-(7-chloroquinazolin-4-yl)morpholine
CID 86889499
2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine
CID 133363520
4-(1H-benzimidazol-2-yl)-2-(2-chlorophenyl)morpholine
CID 133410094
4-(3-phenyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-pyridin-3-ylquinazoline
CID 133327764

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine?
The IUPAC name of 2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine (CID 133289876) is 2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine.
What is the SMILES notation for 2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine?
The canonical SMILES for 2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine is Clc1ccccc1C1CN(c2nc(-c3cccnc3)nc3ccccc23)CCO1.
What is the InChIKey of 2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine?
The InChIKey is BWTUMUUZJNRMIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClN4O/c24-19-9-3-1-7-17(19)21-15-28(12-13-29-21)23-18-8-2-4-10-20(18)26-22(27-23)16-6-5-11-25-14-16/h1-11,14,21H,12-13,15H2.
What are the key properties of 2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine?
2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine has a molecular weight of 402.89 g/mol, XLogP of 4.92, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine is sourced from PubChem (CID 133289876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).