N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide

C19H19ClN2O4 — CID 4932333

IUPACN'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide
SMILESC=CCOc1ccccc1C(=O)NNC(=O)C(C)Oc1ccccc1Cl
InChIInChI=1S/C19H19ClN2O4/c1-3-12-25-16-10-6-4-8-14(16)19(24)22-21-18(23)13(2)26-17-11-7-5-9-15(17)20/h3-11,13H,1,12H2,2H3,(H,21,23)(H,22,24)
InChIKeyWCMJKCOXBSTERX-UHFFFAOYSA-N
MW374.82 g/mol
LogP3.13
Rot. Bonds7

About N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide

N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide (PubChem CID 4932333) has the molecular formula C19H19ClN2O4 and a molecular weight of 374.82 g/mol. Its IUPAC name is N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide.

Molecular Properties

Compound NameN'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide
PubChem CID4932333
Molecular FormulaC19H19ClN2O4
Molecular Weight374.82 g/mol
Exact Mass374.10
IUPAC NameN'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide
SMILESC=CCOc1ccccc1C(=O)NNC(=O)C(C)Oc1ccccc1Cl
InChIInChI=1S/C19H19ClN2O4/c1-3-12-25-16-10-6-4-8-14(16)19(24)22-21-18(23)13(2)26-17-11-7-5-9-15(17)20/h3-11,13H,1,12H2,2H3,(H,21,23)(H,22,24)
InChIKeyWCMJKCOXBSTERX-UHFFFAOYSA-N
XLogP3.13
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.82
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2-bromo-4-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide
CID 4981545
N'-(2-propan-2-yloxybenzoyl)-2-prop-2-enoxybenzohydrazide
CID 17045713
N'-[2-(2-chlorophenoxy)acetyl]-2-prop-2-enoxybenzohydrazide
CID 4929148
1-[[(2R)-2-(2-chlorophenoxy)propanoyl]amino]-3-prop-2-enylthiourea
CID 27509995
N'-[2-(2-chlorophenoxy)propanoyl]-2-nitrobenzohydrazide
CID 4932160
2-(2-chlorophenoxy)-N'-[2-(2-chlorophenoxy)acetyl]propanehydrazide
CID 4932286
3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide
CID 17133664
N'-[2-(2-chlorophenoxy)propanoyl]-3,4-dimethoxybenzohydrazide
CID 4932300
1-[[(2R)-2-(2-chlorophenoxy)propanoyl]amino]-3-methylthiourea
CID 40645974
N'-(2-iodobenzoyl)-2-prop-2-enoxybenzohydrazide
CID 4929047
N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide
CID 4929134
tert-butyl N-[(2-prop-2-enoxybenzoyl)amino]carbamate
CID 137320522

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide?
The IUPAC name of N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide (CID 4932333) is N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide.
What is the SMILES notation for N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide?
The canonical SMILES for N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide is C=CCOc1ccccc1C(=O)NNC(=O)C(C)Oc1ccccc1Cl.
What is the InChIKey of N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide?
The InChIKey is WCMJKCOXBSTERX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O4/c1-3-12-25-16-10-6-4-8-14(16)19(24)22-21-18(23)13(2)26-17-11-7-5-9-15(17)20/h3-11,13H,1,12H2,2H3,(H,21,23)(H,22,24).
What are the key properties of N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide?
N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide has a molecular weight of 374.82 g/mol, XLogP of 3.13, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide is sourced from PubChem (CID 4932333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).