N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide

C14H16N2O3 — CID 4929134

IUPACN'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide
SMILESC=CCOc1ccccc1C(=O)NNC(=O)C1CC1
InChIInChI=1S/C14H16N2O3/c1-2-9-19-12-6-4-3-5-11(12)14(18)16-15-13(17)10-7-8-10/h2-6,10H,1,7-9H2,(H,15,17)(H,16,18)
InChIKeyLZQKVOMNCGHWSS-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.42
Rot. Bonds5

About N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide

N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide (PubChem CID 4929134) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide.

Molecular Properties

Compound NameN'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide
PubChem CID4929134
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC NameN'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide
SMILESC=CCOc1ccccc1C(=O)NNC(=O)C1CC1
InChIInChI=1S/C14H16N2O3/c1-2-9-19-12-6-4-3-5-11(12)14(18)16-15-13(17)10-7-8-10/h2-6,10H,1,7-9H2,(H,15,17)(H,16,18)
InChIKeyLZQKVOMNCGHWSS-UHFFFAOYSA-N
XLogP1.42
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-cyclopentylacetyl)-2-prop-2-enoxybenzohydrazide
CID 54786488
N'-(2-iodobenzoyl)-2-prop-2-enoxybenzohydrazide
CID 4929047
3-[(2-prop-2-enoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 66032902
N'-(2-propan-2-yloxybenzoyl)-2-prop-2-enoxybenzohydrazide
CID 17045713
N'-[2-(2-chlorophenoxy)acetyl]-2-prop-2-enoxybenzohydrazide
CID 4929148
tert-butyl N-[(2-prop-2-enoxybenzoyl)amino]carbamate
CID 137320522
N'-hexanoyl-2-prop-2-enoxybenzohydrazide
CID 4953986
3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide
CID 17133664
N'-(4-tert-butylbenzoyl)-2-prop-2-enoxybenzohydrazide
CID 4929142
N-piperidin-4-yl-2-prop-2-enoxybenzamide
CID 119390242
N-[(1S,2S)-2-hydroxycyclohexyl]-2-prop-2-enoxybenzamide
CID 104957272
N'-heptanoyl-2-prop-2-enoxybenzohydrazide
CID 54789258

Frequently Asked Questions

What is the IUPAC name of N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide?
The IUPAC name of N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide (CID 4929134) is N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide.
What is the SMILES notation for N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide?
The canonical SMILES for N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide is C=CCOc1ccccc1C(=O)NNC(=O)C1CC1.
What is the InChIKey of N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide?
The InChIKey is LZQKVOMNCGHWSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-2-9-19-12-6-4-3-5-11(12)14(18)16-15-13(17)10-7-8-10/h2-6,10H,1,7-9H2,(H,15,17)(H,16,18).
What are the key properties of N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide?
N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide has a molecular weight of 260.29 g/mol, XLogP of 1.42, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide is sourced from PubChem (CID 4929134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).