1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine

C21H23N5O — CID 175553566

IUPAC1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine
SMILESc1cc(N2CCOCC2)ccc1-c1ccc2cnc(NNC3CC3)nc2c1
InChIInChI=1S/C21H23N5O/c1-2-17-14-22-21(25-24-18-5-6-18)23-20(17)13-16(1)15-3-7-19(8-4-15)26-9-11-27-12-10-26/h1-4,7-8,13-14,18,24H,5-6,9-12H2,(H,22,23,25)
InChIKeyHIDZJVOJFTUSRG-UHFFFAOYSA-N
MW361.45 g/mol
LogP3.21
Rot. Bonds5

About 1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine

1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine (PubChem CID 175553566) has the molecular formula C21H23N5O and a molecular weight of 361.45 g/mol. Its IUPAC name is 1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine.

Molecular Properties

Compound Name1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine
PubChem CID175553566
Molecular FormulaC21H23N5O
Molecular Weight361.45 g/mol
Exact Mass361.19
IUPAC Name1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine
SMILESc1cc(N2CCOCC2)ccc1-c1ccc2cnc(NNC3CC3)nc2c1
InChIInChI=1S/C21H23N5O/c1-2-17-14-22-21(25-24-18-5-6-18)23-20(17)13-16(1)15-3-7-19(8-4-15)26-9-11-27-12-10-26/h1-4,7-8,13-14,18,24H,5-6,9-12H2,(H,22,23,25)
InChIKeyHIDZJVOJFTUSRG-UHFFFAOYSA-N
XLogP3.21
TPSA62.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine?
The IUPAC name of 1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine (CID 175553566) is 1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine.
What is the SMILES notation for 1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine?
The canonical SMILES for 1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine is c1cc(N2CCOCC2)ccc1-c1ccc2cnc(NNC3CC3)nc2c1.
What is the InChIKey of 1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine?
The InChIKey is HIDZJVOJFTUSRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O/c1-2-17-14-22-21(25-24-18-5-6-18)23-20(17)13-16(1)15-3-7-19(8-4-15)26-9-11-27-12-10-26/h1-4,7-8,13-14,18,24H,5-6,9-12H2,(H,22,23,25).
What are the key properties of 1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine?
1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine has a molecular weight of 361.45 g/mol, XLogP of 3.21, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[7-(4-morpholin-4-ylphenyl)quinazolin-2-yl]hydrazine is sourced from PubChem (CID 175553566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).