4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine

C22H24N4O — CID 135726038

IUPAC4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine
SMILESCc1ccc2c(c1)-c1cc(C)nn1[C@@H](c1ccc(N3CCOCC3)cc1)N2
InChIInChI=1S/C22H24N4O/c1-15-3-8-20-19(13-15)21-14-16(2)24-26(21)22(23-20)17-4-6-18(7-5-17)25-9-11-27-12-10-25/h3-8,13-14,22-23H,9-12H2,1-2H3/t22-/m0/s1
InChIKeyULSZFVAICQHTCD-QFIPXVFZSA-N
MW360.46 g/mol
LogP3.98
Rot. Bonds2

About 4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine

4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine (PubChem CID 135726038) has the molecular formula C22H24N4O and a molecular weight of 360.46 g/mol. Its IUPAC name is 4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine.

Molecular Properties

Compound Name4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine
PubChem CID135726038
Molecular FormulaC22H24N4O
Molecular Weight360.46 g/mol
Exact Mass360.20
IUPAC Name4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine
SMILESCc1ccc2c(c1)-c1cc(C)nn1[C@@H](c1ccc(N3CCOCC3)cc1)N2
InChIInChI=1S/C22H24N4O/c1-15-3-8-20-19(13-15)21-14-16(2)24-26(21)22(23-20)17-4-6-18(7-5-17)25-9-11-27-12-10-25/h3-8,13-14,22-23H,9-12H2,1-2H3/t22-/m0/s1
InChIKeyULSZFVAICQHTCD-QFIPXVFZSA-N
XLogP3.98
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine with MolForge

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Related Compounds

4-[4-[(5R)-2,7-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine
CID 982258
4-[(5S)-2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenol
CID 1095515
(2S)-3-(4-methylphenyl)-2-(4-morpholin-4-ylphenyl)-1,2-dihydroquinazolin-4-one
CID 25363719
2-(2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)-5-methoxyphenol
CID 3878015
16-(4-methylphenyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 71419396
3,3-dimethyl-2-(4-morpholin-4-ylphenyl)-2,4-dihydro-1H-quinoline-6-carboxylic acid
CID 53491833
(2R)-3-benzyl-2-(4-morpholin-4-ylphenyl)-1,2-dihydroquinazolin-4-one
CID 9006737
6-methyl-N-(4-morpholin-4-ylphenyl)-1H-benzimidazol-2-amine
CID 110376992
ethane;(4-methylphenyl)-[4-[(4-morpholin-4-ylphenyl)diazenyl]phenyl]diazene
CID 157373423
4-[4-[(1S,2S)-2-methylcyclopropyl]phenyl]morpholine
CID 166443931
1-cyclohexyl-3-methyl-4-(4-morpholin-4-ylphenyl)pyrazolo[5,4-b]pyridine-6-carboxylic acid
CID 126741501
5-morpholin-4-yl-1H-indole-2,3-dione
CID 16781550

Frequently Asked Questions

What is the IUPAC name of 4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine?
The IUPAC name of 4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine (CID 135726038) is 4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine.
What is the SMILES notation for 4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine?
The canonical SMILES for 4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine is Cc1ccc2c(c1)-c1cc(C)nn1[C@@H](c1ccc(N3CCOCC3)cc1)N2.
What is the InChIKey of 4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine?
The InChIKey is ULSZFVAICQHTCD-QFIPXVFZSA-N. The full InChI is InChI=1S/C22H24N4O/c1-15-3-8-20-19(13-15)21-14-16(2)24-26(21)22(23-20)17-4-6-18(7-5-17)25-9-11-27-12-10-25/h3-8,13-14,22-23H,9-12H2,1-2H3/t22-/m0/s1.
What are the key properties of 4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine?
4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine has a molecular weight of 360.46 g/mol, XLogP of 3.98, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine is sourced from PubChem (CID 135726038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).