N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide

C14H18N2O — CID 4744638

IUPACN'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide
SMILESCc1ccc(C(=O)NNC2=CCCC2)cc1C
InChIInChI=1S/C14H18N2O/c1-10-7-8-12(9-11(10)2)14(17)16-15-13-5-3-4-6-13/h5,7-9,15H,3-4,6H2,1-2H3,(H,16,17)
InChIKeyGPERTBYVZPCUAC-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.61
Rot. Bonds3

About N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide

N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide (PubChem CID 4744638) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide.

Molecular Properties

Compound NameN'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide
PubChem CID4744638
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC NameN'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide
SMILESCc1ccc(C(=O)NNC2=CCCC2)cc1C
InChIInChI=1S/C14H18N2O/c1-10-7-8-12(9-11(10)2)14(17)16-15-13-5-3-4-6-13/h5,7-9,15H,3-4,6H2,1-2H3,(H,16,17)
InChIKeyGPERTBYVZPCUAC-UHFFFAOYSA-N
XLogP2.61
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-(cyclohexen-1-yl)-4-(phenylsulfanylmethyl)benzohydrazide
CID 3663481
N-cyclobutyl-3,4-dimethylbenzamide;ethane
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N'-(cyclohexen-1-yl)-2-hydroxybenzohydrazide
CID 4231723
N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide
CID 117060839
N-(cyclohexylmethyl)-3,4-dimethylbenzamide
CID 55349047
N'-butyl-3,4-dimethylbenzohydrazide
CID 162213335
N'-(3-chlorobenzoyl)-3,4-dimethylbenzohydrazide
CID 7918365
3,4-dimethyl-N-(2-piperidin-1-ylethyl)benzamide
CID 25237097
N'-(cyclohepten-1-yl)-3-morpholin-4-ylsulfonylbenzohydrazide
CID 2588973
N-(diaminomethyl)-3,4-dimethylbenzamide
CID 154522714
N-[1-(hydroxymethyl)cyclopropyl]-3,4-dimethylbenzamide
CID 115764896
3,4-dimethyl-N-(4-methylphenyl)benzamide
CID 3950718

Frequently Asked Questions

What is the IUPAC name of N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide?
The IUPAC name of N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide (CID 4744638) is N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide.
What is the SMILES notation for N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide?
The canonical SMILES for N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide is Cc1ccc(C(=O)NNC2=CCCC2)cc1C.
What is the InChIKey of N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide?
The InChIKey is GPERTBYVZPCUAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-10-7-8-12(9-11(10)2)14(17)16-15-13-5-3-4-6-13/h5,7-9,15H,3-4,6H2,1-2H3,(H,16,17).
What are the key properties of N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide?
N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide has a molecular weight of 230.31 g/mol, XLogP of 2.61, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide is sourced from PubChem (CID 4744638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).