(2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid

C12H11N3O2 — CID 10059695

IUPAC(2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid
SMILESC/C(=N\Nc1ccc2ccccc2n1)C(=O)O
InChIInChI=1S/C12H11N3O2/c1-8(12(16)17)14-15-11-7-6-9-4-2-3-5-10(9)13-11/h2-7H,1H3,(H,13,15)(H,16,17)/b14-8+
InChIKeyMUNZYKHGMFUCIE-RIYZIHGNSA-N
MW229.24 g/mol
LogP2.11
Rot. Bonds3

About (2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid

(2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid (PubChem CID 10059695) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is (2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid.

Molecular Properties

Compound Name(2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid
PubChem CID10059695
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC Name(2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid
SMILESC/C(=N\Nc1ccc2ccccc2n1)C(=O)O
InChIInChI=1S/C12H11N3O2/c1-8(12(16)17)14-15-11-7-6-9-4-2-3-5-10(9)13-11/h2-7H,1H3,(H,13,15)(H,16,17)/b14-8+
InChIKeyMUNZYKHGMFUCIE-RIYZIHGNSA-N
XLogP2.11
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(1-phenylethylideneamino)quinolin-2-amine
CID 618819
sodium N-quinolin-2-ylnitrous amide
CID 54608705
(2Z)-2-[(2-methylquinolin-4-yl)hydrazinylidene]propanoic acid
CID 6849850
N-[4-(furan-2-yl)but-3-en-2-ylideneamino]quinolin-2-amine
CID 3319597
2,2,3-trimethyl-3-(quinolin-2-ylamino)butanoic acid
CID 65266135
3-[(quinolin-2-ylamino)methyl]pentanoic acid
CID 81067138
2-amino-N-quinolin-2-ylacetamide
CID 54505370
3,3-dimethyl-5-oxo-5-(quinolin-2-ylamino)pentanoic acid
CID 2812549
quinolin-2-ylsulfamic acid
CID 141346931
2-[(quinolin-2-ylamino)methyl]pentanoic acid
CID 65224429
methyl 3-(quinolin-2-ylamino)propanoate
CID 60632060
N-ethyl-2-(quinolin-2-ylamino)acetamide
CID 43398620

Frequently Asked Questions

What is the IUPAC name of (2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid?
The IUPAC name of (2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid (CID 10059695) is (2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid.
What is the SMILES notation for (2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid?
The canonical SMILES for (2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid is C/C(=N\Nc1ccc2ccccc2n1)C(=O)O.
What is the InChIKey of (2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid?
The InChIKey is MUNZYKHGMFUCIE-RIYZIHGNSA-N. The full InChI is InChI=1S/C12H11N3O2/c1-8(12(16)17)14-15-11-7-6-9-4-2-3-5-10(9)13-11/h2-7H,1H3,(H,13,15)(H,16,17)/b14-8+.
What are the key properties of (2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid?
(2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid has a molecular weight of 229.24 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid is sourced from PubChem (CID 10059695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).