4-hydrazinyl-7-phenylmethoxyquinolin-3-amine

C16H16N4O — CID 69151433

IUPAC4-hydrazinyl-7-phenylmethoxyquinolin-3-amine
SMILESNNc1c(N)cnc2cc(OCc3ccccc3)ccc12
InChIInChI=1S/C16H16N4O/c17-14-9-19-15-8-12(6-7-13(15)16(14)20-18)21-10-11-4-2-1-3-5-11/h1-9H,10,17-18H2,(H,19,20)
InChIKeyXVHMCUGGLUUMNU-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.68
Rot. Bonds4

About 4-hydrazinyl-7-phenylmethoxyquinolin-3-amine

4-hydrazinyl-7-phenylmethoxyquinolin-3-amine (PubChem CID 69151433) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 4-hydrazinyl-7-phenylmethoxyquinolin-3-amine.

Molecular Properties

Compound Name4-hydrazinyl-7-phenylmethoxyquinolin-3-amine
PubChem CID69151433
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name4-hydrazinyl-7-phenylmethoxyquinolin-3-amine
SMILESNNc1c(N)cnc2cc(OCc3ccccc3)ccc12
InChIInChI=1S/C16H16N4O/c17-14-9-19-15-8-12(6-7-13(15)16(14)20-18)21-10-11-4-2-1-3-5-11/h1-9H,10,17-18H2,(H,19,20)
InChIKeyXVHMCUGGLUUMNU-UHFFFAOYSA-N
XLogP2.68
TPSA86.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.68
H-Bond Donors ≤ 53
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-chloro-6-phenylmethoxyquinolin-3-amine
CID 102614162
4-[(3-amino-7-phenylmethoxyquinolin-4-yl)amino]butyl-tert-butylcarbamic acid
CID 67050943
7-bromo-4-hydrazinylquinolin-3-amine
CID 69152576
(4-chloro-7-phenylmethoxyquinolin-3-yl)methanol
CID 169092914
3,4-dichloro-6-phenylmethoxyquinoline
CID 114759785
2-phenyl-6-phenylmethoxyquinolin-4-amine
CID 113232549
2-ethyl-6-phenylmethoxyquinolin-4-amine
CID 62204129
ethane;7-phenylmethoxy-3H-quinazolin-4-one
CID 136656815
(3-phenylmethoxyphenyl)hydrazine;hydrochloride
CID 12891839
2-(aminomethyl)-4-phenylmethoxyaniline
CID 156839624
7-phenylmethoxy-4-pyridin-3-ylquinazoline
CID 69163736
1-N-phenyl-4-phenylmethoxybenzene-1,2-diamine
CID 70695574

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-7-phenylmethoxyquinolin-3-amine?
The IUPAC name of 4-hydrazinyl-7-phenylmethoxyquinolin-3-amine (CID 69151433) is 4-hydrazinyl-7-phenylmethoxyquinolin-3-amine.
What is the SMILES notation for 4-hydrazinyl-7-phenylmethoxyquinolin-3-amine?
The canonical SMILES for 4-hydrazinyl-7-phenylmethoxyquinolin-3-amine is NNc1c(N)cnc2cc(OCc3ccccc3)ccc12.
What is the InChIKey of 4-hydrazinyl-7-phenylmethoxyquinolin-3-amine?
The InChIKey is XVHMCUGGLUUMNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c17-14-9-19-15-8-12(6-7-13(15)16(14)20-18)21-10-11-4-2-1-3-5-11/h1-9H,10,17-18H2,(H,19,20).
What are the key properties of 4-hydrazinyl-7-phenylmethoxyquinolin-3-amine?
4-hydrazinyl-7-phenylmethoxyquinolin-3-amine has a molecular weight of 280.33 g/mol, XLogP of 2.68, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-7-phenylmethoxyquinolin-3-amine is sourced from PubChem (CID 69151433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).