N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide

C15H21N3O2 — CID 114120831

IUPACN-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide
SMILESCc1ccc(NN)c(C(=O)NC2CCOC2C2CC2)c1
InChIInChI=1S/C15H21N3O2/c1-9-2-5-12(18-16)11(8-9)15(19)17-13-6-7-20-14(13)10-3-4-10/h2,5,8,10,13-14,18H,3-4,6-7,16H2,1H3,(H,17,19)
InChIKeyJUBZTRAXGLMWJU-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.58
Rot. Bonds4

About N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide

N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide (PubChem CID 114120831) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide.

Molecular Properties

Compound NameN-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide
PubChem CID114120831
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide
SMILESCc1ccc(NN)c(C(=O)NC2CCOC2C2CC2)c1
InChIInChI=1S/C15H21N3O2/c1-9-2-5-12(18-16)11(8-9)15(19)17-13-6-7-20-14(13)10-3-4-10/h2,5,8,10,13-14,18H,3-4,6-7,16H2,1H3,(H,17,19)
InChIKeyJUBZTRAXGLMWJU-UHFFFAOYSA-N
XLogP1.58
TPSA76.38 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-cyclopropyloxolan-3-yl)-2-hydrazinylbenzamide
CID 114120833
5-methyl-2-(methylamino)-N-(2-methyloxolan-3-yl)benzamide
CID 82736309
N-(3-ethyl-2-methylcyclopentyl)-2-hydrazinyl-5-methylbenzamide
CID 64914858
1-N-(2-cyclopropyloxolan-3-yl)-4-methylbenzene-1,2-diamine
CID 114118630
2-hydrazinyl-5-methyl-N-(2,2,3,3-tetramethylcyclopropyl)benzamide
CID 79357089
N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 113341333
N-(4-ethylcyclohexyl)-2-hydrazinyl-5-methylbenzamide
CID 62511302
2-bromo-N-(2-cyclopropyloxolan-3-yl)-5-fluorobenzamide
CID 103864687
2-amino-N-(2-cyclopropyloxolan-3-yl)pyridine-3-carboxamide
CID 114120759
2-fluoro-4-methyl-N-(2-methyloxolan-3-yl)benzamide
CID 82725770
2-fluoro-5-methyl-N-(2-methyloxolan-3-yl)benzamide
CID 82726276
3,5-dibromo-N-(2-cyclopropyloxolan-3-yl)benzamide
CID 103908532

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide?
The IUPAC name of N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide (CID 114120831) is N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide.
What is the SMILES notation for N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide?
The canonical SMILES for N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide is Cc1ccc(NN)c(C(=O)NC2CCOC2C2CC2)c1.
What is the InChIKey of N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide?
The InChIKey is JUBZTRAXGLMWJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-9-2-5-12(18-16)11(8-9)15(19)17-13-6-7-20-14(13)10-3-4-10/h2,5,8,10,13-14,18H,3-4,6-7,16H2,1H3,(H,17,19).
What are the key properties of N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide?
N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide has a molecular weight of 275.35 g/mol, XLogP of 1.58, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyloxolan-3-yl)-2-hydrazinyl-5-methylbenzamide is sourced from PubChem (CID 114120831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).