N'-propylbenzohydrazide

C10H14N2O — CID 22955337

IUPACN'-propylbenzohydrazide
SMILESCCCNNC(=O)c1ccccc1
InChIInChI=1S/C10H14N2O/c1-2-8-11-12-10(13)9-6-4-3-5-7-9/h3-7,11H,2,8H2,1H3,(H,12,13)
InChIKeyKVIDRTHIJIXBDS-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.33
Rot. Bonds4

About N'-propylbenzohydrazide

N'-propylbenzohydrazide (PubChem CID 22955337) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is N'-propylbenzohydrazide.

Molecular Properties

Compound NameN'-propylbenzohydrazide
PubChem CID22955337
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC NameN'-propylbenzohydrazide
SMILESCCCNNC(=O)c1ccccc1
InChIInChI=1S/C10H14N2O/c1-2-8-11-12-10(13)9-6-4-3-5-7-9/h3-7,11H,2,8H2,1H3,(H,12,13)
InChIKeyKVIDRTHIJIXBDS-UHFFFAOYSA-N
XLogP1.33
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Procarbazine
CID 4915
Procarbazine Hydrochloride
CID 9703
Benzoylhydrazine
CID 11955
Benmoxin
CID 71671
Pivalylbenzhydrazine
CID 9375
Isophthalyl dihydrazide
CID 72700
4-Methylbenzamide
CID 69274
Benzeneacetic acid, hydrazide
CID 70301
2-(Aminothioxomethyl)benzohydrazide
CID 781748
Benzoic acid, 2-benzoylhydrazide
CID 13085
UF010
CID 4596836
p-Toluohydrazide
CID 77174

Frequently Asked Questions

What is the IUPAC name of N'-propylbenzohydrazide?
The IUPAC name of N'-propylbenzohydrazide (CID 22955337) is N'-propylbenzohydrazide.
What is the SMILES notation for N'-propylbenzohydrazide?
The canonical SMILES for N'-propylbenzohydrazide is CCCNNC(=O)c1ccccc1.
What is the InChIKey of N'-propylbenzohydrazide?
The InChIKey is KVIDRTHIJIXBDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-2-8-11-12-10(13)9-6-4-3-5-7-9/h3-7,11H,2,8H2,1H3,(H,12,13).
What are the key properties of N'-propylbenzohydrazide?
N'-propylbenzohydrazide has a molecular weight of 178.24 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-propylbenzohydrazide is sourced from PubChem (CID 22955337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).