[4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine

C18H19N5 — CID 156536871

IUPAC[4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine
SMILESNNc1nc(N2CCCCc3ccccc32)c2ccccc2n1
InChIInChI=1S/C18H19N5/c19-22-18-20-15-10-3-2-9-14(15)17(21-18)23-12-6-5-8-13-7-1-4-11-16(13)23/h1-4,7,9-11H,5-6,8,12,19H2,(H,20,21,22)
InChIKeyMGXPMPOKVXZTJU-UHFFFAOYSA-N
MW305.39 g/mol
LogP3.39
Rot. Bonds2

About [4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine

[4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine (PubChem CID 156536871) has the molecular formula C18H19N5 and a molecular weight of 305.39 g/mol. Its IUPAC name is [4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine
PubChem CID156536871
Molecular FormulaC18H19N5
Molecular Weight305.39 g/mol
Exact Mass305.16
IUPAC Name[4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine
SMILESNNc1nc(N2CCCCc3ccccc32)c2ccccc2n1
InChIInChI=1S/C18H19N5/c19-22-18-20-15-10-3-2-9-14(15)17(21-18)23-12-6-5-8-13-7-1-4-11-16(13)23/h1-4,7,9-11H,5-6,8,12,19H2,(H,20,21,22)
InChIKeyMGXPMPOKVXZTJU-UHFFFAOYSA-N
XLogP3.39
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.39
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[4-(1,3-dihydroisoindol-2-yl)quinazolin-2-yl]hydrazine
CID 80902799
[4-(2-methylpiperidin-1-yl)quinazolin-2-yl]hydrazine
CID 80928083
[4-(2,3-dimethylpiperidin-1-yl)quinazolin-2-yl]hydrazine
CID 80908196
N-[4-(3,4,5,6-tetrahydro-2H-1-benzazocin-1-yl)pyrido[3,4-d]pyrimidin-2-yl]buta-2,3-dienamide
CID 54458995
5-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)-[1,2,4]triazolo[4,3-a]quinazoline
CID 156537559
[4-(4-cyclopropylpiperazin-1-yl)quinazolin-2-yl]hydrazine
CID 80900421
[6-(3,4-dihydro-2H-quinolin-1-yl)-3,5-difluoro-2-pyridinyl]hydrazine
CID 114073397
1-(2-hydrazinylquinazolin-4-yl)piperidin-3-ol
CID 80906442
3-(2,3-dihydroindol-1-yl)quinoxalin-2-amine
CID 102985180
4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)-1,3,5-triazin-2-amine
CID 112746241
2-[4-(2-hydrazinylquinazolin-4-yl)piperazin-1-yl]ethanol
CID 80898065
[4-(3,4-dimethoxypyrrolidin-1-yl)quinazolin-2-yl]hydrazine
CID 103542119

Frequently Asked Questions

What is the IUPAC name of [4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine?
The IUPAC name of [4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine (CID 156536871) is [4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine.
What is the SMILES notation for [4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine?
The canonical SMILES for [4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine is NNc1nc(N2CCCCc3ccccc32)c2ccccc2n1.
What is the InChIKey of [4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine?
The InChIKey is MGXPMPOKVXZTJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5/c19-22-18-20-15-10-3-2-9-14(15)17(21-18)23-12-6-5-8-13-7-1-4-11-16(13)23/h1-4,7,9-11H,5-6,8,12,19H2,(H,20,21,22).
What are the key properties of [4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine?
[4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine has a molecular weight of 305.39 g/mol, XLogP of 3.39, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)quinazolin-2-yl]hydrazine is sourced from PubChem (CID 156536871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).