1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide

C20H22N4O2 — CID 138619870

IUPAC1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide
SMILESC=CCc1ccc(NNC(=O)C(=O)NNc2ccc(CC=C)cc2)cc1
InChIInChI=1S/C20H22N4O2/c1-3-5-15-7-11-17(12-8-15)21-23-19(25)20(26)24-22-18-13-9-16(6-4-2)10-14-18/h3-4,7-14,21-22H,1-2,5-6H2,(H,23,25)(H,24,26)
InChIKeyDRLWRFXHBVHDPG-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.73
Rot. Bonds8

About 1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide

1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide (PubChem CID 138619870) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide.

Molecular Properties

Compound Name1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide
PubChem CID138619870
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide
SMILESC=CCc1ccc(NNC(=O)C(=O)NNc2ccc(CC=C)cc2)cc1
InChIInChI=1S/C20H22N4O2/c1-3-5-15-7-11-17(12-8-15)21-23-19(25)20(26)24-22-18-13-9-16(6-4-2)10-14-18/h3-4,7-14,21-22H,1-2,5-6H2,(H,23,25)(H,24,26)
InChIKeyDRLWRFXHBVHDPG-UHFFFAOYSA-N
XLogP2.73
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.73
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N,N'-bis(4-prop-2-enylphenyl)ethane-1,2-diamine
CID 67265564
N-(4-prop-2-enylphenyl)benzamide
CID 67934091
N,4-bis(prop-2-enyl)aniline
CID 68976817
1,2-bis[4-(4-prop-2-enylphenyl)phenyl]ethane-1,2-dione
CID 67848404
bis(1-prop-2-enyl-4-(4-prop-2-enylphenyl)benzene);hydrate
CID 174815878
bis(4-prop-2-enylphenyl)iodanium
CID 87130865
N-ethyl-4-prop-2-enylbenzamide
CID 137333139
bis(4-prop-2-enylphenyl) (Z)-but-2-enedioate
CID 67944878
fluoro 4-prop-2-enylbenzoate
CID 20652812
(4-prop-2-enylphenyl)phosphonic acid
CID 67861576
[4-(hydroxymethyl)anilino]carbamic acid
CID 150482547
4-prop-2-enylbenzenesulfonic acid
CID 19098643

Frequently Asked Questions

What is the IUPAC name of 1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide?
The IUPAC name of 1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide (CID 138619870) is 1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide.
What is the SMILES notation for 1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide?
The canonical SMILES for 1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide is C=CCc1ccc(NNC(=O)C(=O)NNc2ccc(CC=C)cc2)cc1.
What is the InChIKey of 1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide?
The InChIKey is DRLWRFXHBVHDPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-3-5-15-7-11-17(12-8-15)21-23-19(25)20(26)24-22-18-13-9-16(6-4-2)10-14-18/h3-4,7-14,21-22H,1-2,5-6H2,(H,23,25)(H,24,26).
What are the key properties of 1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide?
1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide has a molecular weight of 350.42 g/mol, XLogP of 2.73, 8 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N',2-N'-bis(4-prop-2-enylphenyl)ethanedihydrazide is sourced from PubChem (CID 138619870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).