N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide

C14H19F2N3O — CID 63656584

IUPACN-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide
SMILESCN(CC1CCCC1)C(=O)c1cc(F)c(NN)c(F)c1
InChIInChI=1S/C14H19F2N3O/c1-19(8-9-4-2-3-5-9)14(20)10-6-11(15)13(18-17)12(16)7-10/h6-7,9,18H,2-5,8,17H2,1H3
InChIKeyJIBFKPKIHLQGGV-UHFFFAOYSA-N
MW283.32 g/mol
LogP2.51
Rot. Bonds4

About N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide

N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide (PubChem CID 63656584) has the molecular formula C14H19F2N3O and a molecular weight of 283.32 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide
PubChem CID63656584
Molecular FormulaC14H19F2N3O
Molecular Weight283.32 g/mol
Exact Mass283.15
IUPAC NameN-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide
SMILESCN(CC1CCCC1)C(=O)c1cc(F)c(NN)c(F)c1
InChIInChI=1S/C14H19F2N3O/c1-19(8-9-4-2-3-5-9)14(20)10-6-11(15)13(18-17)12(16)7-10/h6-7,9,18H,2-5,8,17H2,1H3
InChIKeyJIBFKPKIHLQGGV-UHFFFAOYSA-N
XLogP2.51
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.32
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-4-ylmethyl)benzamide
CID 63707118
4-amino-N-(cyclobutylmethyl)-3-fluoro-N-methylbenzamide
CID 62862148
N-(cyclopropylmethyl)-3-fluoro-2-hydrazinyl-N-methylbenzamide
CID 62660100
N-(cyclohexylmethyl)-2-hydrazinyl-N-methylpyridine-4-carboxamide
CID 62244049
3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide
CID 63185292
3-amino-5-fluoro-N,4-dimethyl-N-(oxan-4-ylmethyl)benzamide
CID 63727256
4-amino-3-fluoro-N-methyl-N-(oxan-4-ylmethyl)benzamide
CID 63726052
N-(cyclopentylmethyl)-2-hydrazinyl-N-methylbenzamide
CID 63656583
2-bromo-5-[cyclopropylmethyl(methyl)carbamoyl]-3-fluorobenzenesulfonyl chloride
CID 65372891
5-chloro-N-(cyclobutylmethyl)-6-hydrazinyl-N-methylpyridine-3-carboxamide
CID 62854972
3,5-difluoro-4-hydrazinyl-N-methyl-N-propan-2-ylbenzamide
CID 63186596
N-(cyclohexylmethyl)-4-hydroxy-N-methylbenzamide
CID 54948596

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide?
The IUPAC name of N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide (CID 63656584) is N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide.
What is the SMILES notation for N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide?
The canonical SMILES for N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide is CN(CC1CCCC1)C(=O)c1cc(F)c(NN)c(F)c1.
What is the InChIKey of N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide?
The InChIKey is JIBFKPKIHLQGGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2N3O/c1-19(8-9-4-2-3-5-9)14(20)10-6-11(15)13(18-17)12(16)7-10/h6-7,9,18H,2-5,8,17H2,1H3.
What are the key properties of N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide?
N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide has a molecular weight of 283.32 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide is sourced from PubChem (CID 63656584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).