N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide

C11H14FN3O — CID 137354234

IUPACN'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide
SMILESCC1(C(=O)NNc2ccc(F)cn2)CCC1
InChIInChI=1S/C11H14FN3O/c1-11(5-2-6-11)10(16)15-14-9-4-3-8(12)7-13-9/h3-4,7H,2,5-6H2,1H3,(H,13,14)(H,15,16)
InChIKeyJPGPWEBPSVDPDY-UHFFFAOYSA-N
MW223.25 g/mol
LogP1.85
Rot. Bonds3

About N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide

N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide (PubChem CID 137354234) has the molecular formula C11H14FN3O and a molecular weight of 223.25 g/mol. Its IUPAC name is N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide.

Molecular Properties

Compound NameN'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide
PubChem CID137354234
Molecular FormulaC11H14FN3O
Molecular Weight223.25 g/mol
Exact Mass223.11
IUPAC NameN'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide
SMILESCC1(C(=O)NNc2ccc(F)cn2)CCC1
InChIInChI=1S/C11H14FN3O/c1-11(5-2-6-11)10(16)15-14-9-4-3-8(12)7-13-9/h3-4,7H,2,5-6H2,1H3,(H,13,14)(H,15,16)
InChIKeyJPGPWEBPSVDPDY-UHFFFAOYSA-N
XLogP1.85
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl (2S)-2-[[(5-fluoro-2-pyridinyl)amino]carbamoyl]-2-methylpyrrolidine-1-carboxylate
CID 129277246
N-(5-fluoro-2-pyridinyl)-1-methylsulfanylcyclopropane-1-carboxamide
CID 126770682
(2S)-N'-(5-fluoro-2-pyridinyl)-2-methylbutanehydrazide
CID 137354634
1-[(5-fluoro-2-pyridinyl)carbamoyl]cyclobutane-1-carboxylic acid
CID 65481473
tert-butyl N-[(5-fluoro-2-pyridinyl)amino]carbamate
CID 124909096
N'-(5-fluoro-2-pyridinyl)-4-azaspiro[2.5]octane-4-carbohydrazide
CID 86687264
N'-(5-fluoro-2-pyridinyl)-1-methylpiperidine-2-carbohydrazide
CID 123425536
5-fluoro-N-[(1-methylcyclopentyl)methyl]pyridin-2-amine
CID 63830121
5-fluoro-2-[(1-methylcyclohexanecarbonyl)amino]benzoic acid
CID 106826165
1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide
CID 91644069
1-(3-fluorophenyl)-N'-(5-methoxy-2-pyridinyl)cyclobutane-1-carbohydrazide
CID 91650350
N-(6-amino-3-pyridinyl)-1-methylcyclobutane-1-carboxamide;hydrochloride
CID 119515764

Frequently Asked Questions

What is the IUPAC name of N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide?
The IUPAC name of N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide (CID 137354234) is N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide.
What is the SMILES notation for N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide?
The canonical SMILES for N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide is CC1(C(=O)NNc2ccc(F)cn2)CCC1.
What is the InChIKey of N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide?
The InChIKey is JPGPWEBPSVDPDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN3O/c1-11(5-2-6-11)10(16)15-14-9-4-3-8(12)7-13-9/h3-4,7H,2,5-6H2,1H3,(H,13,14)(H,15,16).
What are the key properties of N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide?
N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide has a molecular weight of 223.25 g/mol, XLogP of 1.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide is sourced from PubChem (CID 137354234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).