(2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one

C14H14N4O2 — CID 6525778

IUPAC(2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one
SMILESCc1cccc(N/N=C(/C=N\N)C(=O)c2ccco2)c1
InChIInChI=1S/C14H14N4O2/c1-10-4-2-5-11(8-10)17-18-12(9-16-15)14(19)13-6-3-7-20-13/h2-9,17H,15H2,1H3/b16-9-,18-12-
InChIKeyAKDFNRBKIOVVTO-GKRCIGFLSA-N
MW270.29 g/mol
LogP2.18
Rot. Bonds5

About (2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one

(2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one (PubChem CID 6525778) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is (2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one.

Molecular Properties

Compound Name(2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one
PubChem CID6525778
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC Name(2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one
SMILESCc1cccc(N/N=C(/C=N\N)C(=O)c2ccco2)c1
InChIInChI=1S/C14H14N4O2/c1-10-4-2-5-11(8-10)17-18-12(9-16-15)14(19)13-6-3-7-20-13/h2-9,17H,15H2,1H3/b16-9-,18-12-
InChIKeyAKDFNRBKIOVVTO-GKRCIGFLSA-N
XLogP2.18
TPSA92.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2Z)-2-amino-2-[(3-methylphenyl)hydrazinylidene]acetic acid
CID 68518581
(E)-1-(furan-2-yl)-3-hydroxy-2-[(3-methylphenyl)diazenyl]prop-2-en-1-one
CID 135780099
3-[(2E)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]benzoic acid
CID 16555832
N-(3-chloroanilino)-2-(furan-2-yl)-2-oxoethanimidoyl cyanide
CID 2804250
N-[(1S)-1-(3-methylanilino)-2-oxo-2-phenylethyl]furan-2-carboxamide
CID 7116359
N-[1-(furan-2-yl)ethylideneamino]-3-methylbenzamide
CID 910469
N-(3-methylphenyl)sulfonylfuran-2-carboxamide
CID 47130299
N-[3-[(E)-C-methyl-N-[(3-methylbenzoyl)amino]carbonimidoyl]phenyl]furan-2-carboxamide
CID 5434357
1,1,1-trifluoro-4-(furan-2-yl)-4-hydroxy-3-[(3-methylphenyl)iminomethyl]but-3-en-2-one
CID 135481196
N-[1-(furan-2-yl)ethylideneamino]-3-nitroaniline
CID 3873452
3-(furan-2-yl)-2-(3-methylphenyl)-3-oxopropanenitrile
CID 62829603
N-[5-(3-methylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113031417

Frequently Asked Questions

What is the IUPAC name of (2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one?
The IUPAC name of (2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one (CID 6525778) is (2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one.
What is the SMILES notation for (2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one?
The canonical SMILES for (2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one is Cc1cccc(N/N=C(/C=N\N)C(=O)c2ccco2)c1.
What is the InChIKey of (2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one?
The InChIKey is AKDFNRBKIOVVTO-GKRCIGFLSA-N. The full InChI is InChI=1S/C14H14N4O2/c1-10-4-2-5-11(8-10)17-18-12(9-16-15)14(19)13-6-3-7-20-13/h2-9,17H,15H2,1H3/b16-9-,18-12-.
What are the key properties of (2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one?
(2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one has a molecular weight of 270.29 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,3Z)-1-(furan-2-yl)-3-hydrazinylidene-2-[(3-methylphenyl)hydrazinylidene]propan-1-one is sourced from PubChem (CID 6525778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).