(E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide

C15H13N3O3 — CID 6132769

IUPAC(E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide
SMILESO=C(/C=C/c1ccccc1)NNc1ccccc1[N+](=O)[O-]
InChIInChI=1S/C15H13N3O3/c19-15(11-10-12-6-2-1-3-7-12)17-16-13-8-4-5-9-14(13)18(20)21/h1-11,16H,(H,17,19)/b11-10+
InChIKeyZSYFAGVIBPRLGW-ZHACJKMWSA-N
MW283.29 g/mol
LogP2.75
Rot. Bonds5

About (E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide

(E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide (PubChem CID 6132769) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is (E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide.

Molecular Properties

Compound Name(E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide
PubChem CID6132769
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC Name(E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide
SMILESO=C(/C=C/c1ccccc1)NNc1ccccc1[N+](=O)[O-]
InChIInChI=1S/C15H13N3O3/c19-15(11-10-12-6-2-1-3-7-12)17-16-13-8-4-5-9-14(13)18(20)21/h1-11,16H,(H,17,19)/b11-10+
InChIKeyZSYFAGVIBPRLGW-ZHACJKMWSA-N
XLogP2.75
TPSA84.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(E)-3-(4-fluorophenyl)-N-(2-nitrophenyl)prop-2-enamide
CID 5348458
N'-(2-nitrophenyl)benzohydrazide
CID 3718054
(E)-N'-acetyl-3-(2-nitrophenyl)prop-2-enehydrazide
CID 30769477
N'-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-2-nitrobenzohydrazide
CID 17195557
(E)-N'-(6-nitro-1,3-benzothiazol-2-yl)-3-phenylprop-2-enehydrazide
CID 94844895
(E)-N-(8-nitro-2-oxochromen-3-yl)-3-phenylprop-2-enamide
CID 6014120
4-nitro-N-[2-[[[(E)-3-phenylprop-2-enoyl]amino]carbamoyl]phenyl]benzamide
CID 126006391
(Z)-N-(4-nitrophenyl)-3-phenylprop-2-enamide
CID 92909984
(2-nitrophenyl) (E)-3-phenylprop-2-enoate
CID 905313
3-nitro-N'-(3-phenylprop-2-enoyl)benzohydrazide
CID 3738377
2-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]benzamide
CID 6014839
N-(2-acetylphenyl)-3-(2-nitrophenyl)prop-2-enamide
CID 73449712

Frequently Asked Questions

What is the IUPAC name of (E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide?
The IUPAC name of (E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide (CID 6132769) is (E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide.
What is the SMILES notation for (E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide?
The canonical SMILES for (E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide is O=C(/C=C/c1ccccc1)NNc1ccccc1[N+](=O)[O-].
What is the InChIKey of (E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide?
The InChIKey is ZSYFAGVIBPRLGW-ZHACJKMWSA-N. The full InChI is InChI=1S/C15H13N3O3/c19-15(11-10-12-6-2-1-3-7-12)17-16-13-8-4-5-9-14(13)18(20)21/h1-11,16H,(H,17,19)/b11-10+.
What are the key properties of (E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide?
(E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide has a molecular weight of 283.29 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide is sourced from PubChem (CID 6132769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).