4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine]

C25H22N4O — CID 133413278

IUPAC4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine]
SMILESc1ccc2c(c1)CCC21CN(c2nc(-c3ccncc3)nc3ccccc23)CCO1
InChIInChI=1S/C25H22N4O/c1-3-7-21-18(5-1)9-12-25(21)17-29(15-16-30-25)24-20-6-2-4-8-22(20)27-23(28-24)19-10-13-26-14-11-19/h1-8,10-11,13-14H,9,12,15-17H2
InChIKeyGZUUEUAIFXKXAN-UHFFFAOYSA-N
MW394.48 g/mol
LogP4.37
Rot. Bonds2

About 4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine]

4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine] (PubChem CID 133413278) has the molecular formula C25H22N4O and a molecular weight of 394.48 g/mol. Its IUPAC name is 4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine].

Molecular Properties

Compound Name4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine]
PubChem CID133413278
Molecular FormulaC25H22N4O
Molecular Weight394.48 g/mol
Exact Mass394.18
IUPAC Name4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine]
SMILESc1ccc2c(c1)CCC21CN(c2nc(-c3ccncc3)nc3ccccc23)CCO1
InChIInChI=1S/C25H22N4O/c1-3-7-21-18(5-1)9-12-25(21)17-29(15-16-30-25)24-20-6-2-4-8-22(20)27-23(28-24)19-10-13-26-14-11-19/h1-8,10-11,13-14H,9,12,15-17H2
InChIKeyGZUUEUAIFXKXAN-UHFFFAOYSA-N
XLogP4.37
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.48
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine] with MolForge

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Related Compounds

2-pyridin-4-yl-4-pyrrolidin-1-ylquinazoline
CID 659763
4-(4,4-difluoropiperidin-1-yl)-2-pyridin-4-ylquinazoline
CID 71296020
2-spiro[1,2-dihydroindene-3,2'-morpholine]-4'-ylpyridine-3-carbonitrile
CID 133413209
4-piperidin-1-yl-2-pyridin-4-ylquinazoline
CID 820815
4'-(8-methylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine]
CID 133413414
9-(2-thiophen-3-ylquinazolin-4-yl)-2,6-dioxa-9-azaspiro[4.5]decane
CID 133479287
4'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]spiro[1,2-dihydroindene-3,2'-morpholine]
CID 133413339
4'-(5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)spiro[1,2-dihydroindene-3,2'-morpholine]
CID 133413447
5-chloro-2-spiro[1,2-dihydroindene-3,2'-morpholine]-4'-ylbenzonitrile
CID 133413282
5-(spiro[1,2-dihydroindene-3,2'-morpholine]-4'-carbonyl)pyridine-3-carboxylic acid
CID 146136989
1-(2-pyridin-4-ylquinazolin-4-yl)piperidin-3-ol
CID 11415528
4-[4-(2-phenylethyl)piperazin-1-yl]-2-pyridin-4-ylquinazoline
CID 24626620

Frequently Asked Questions

What is the IUPAC name of 4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine]?
The IUPAC name of 4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine] (CID 133413278) is 4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine].
What is the SMILES notation for 4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine]?
The canonical SMILES for 4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine] is c1ccc2c(c1)CCC21CN(c2nc(-c3ccncc3)nc3ccccc23)CCO1.
What is the InChIKey of 4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine]?
The InChIKey is GZUUEUAIFXKXAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N4O/c1-3-7-21-18(5-1)9-12-25(21)17-29(15-16-30-25)24-20-6-2-4-8-22(20)27-23(28-24)19-10-13-26-14-11-19/h1-8,10-11,13-14H,9,12,15-17H2.
What are the key properties of 4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine]?
4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine] has a molecular weight of 394.48 g/mol, XLogP of 4.37, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4'-(2-pyridin-4-ylquinazolin-4-yl)spiro[1,2-dihydroindene-3,2'-morpholine] is sourced from PubChem (CID 133413278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).