1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide

C15H15FN4O — CID 91644069

IUPAC1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide
SMILESO=C(NNc1cnccn1)C1(c2ccc(F)cc2)CCC1
InChIInChI=1S/C15H15FN4O/c16-12-4-2-11(3-5-12)15(6-1-7-15)14(21)20-19-13-10-17-8-9-18-13/h2-5,8-10H,1,6-7H2,(H,18,19)(H,20,21)
InChIKeyYAWFXAVCWNRYNM-UHFFFAOYSA-N
MW286.31 g/mol
LogP2.18
Rot. Bonds4

About 1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide

1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide (PubChem CID 91644069) has the molecular formula C15H15FN4O and a molecular weight of 286.31 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide
PubChem CID91644069
Molecular FormulaC15H15FN4O
Molecular Weight286.31 g/mol
Exact Mass286.12
IUPAC Name1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide
SMILESO=C(NNc1cnccn1)C1(c2ccc(F)cc2)CCC1
InChIInChI=1S/C15H15FN4O/c16-12-4-2-11(3-5-12)15(6-1-7-15)14(21)20-19-13-10-17-8-9-18-13/h2-5,8-10H,1,6-7H2,(H,18,19)(H,20,21)
InChIKeyYAWFXAVCWNRYNM-UHFFFAOYSA-N
XLogP2.18
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(4-fluorophenyl)-N-pyrazin-2-ylsulfonylcyclobutane-1-carboxamide
CID 99696724
1-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)cyclopentane-1-carboxamide
CID 51155660
N'-(5-fluoro-2-pyridinyl)-1-methylcyclobutane-1-carbohydrazide
CID 137354234
1-(3-fluorophenyl)-N'-(5-methoxy-2-pyridinyl)cyclobutane-1-carbohydrazide
CID 91650350
1-(4-fluorophenyl)-N-[(1-methylimidazol-2-yl)methyl]cyclobutane-1-carboxamide
CID 110438262
N-(2,6-difluorophenyl)-1-(4-fluorophenyl)cyclobutane-1-carboxamide
CID 110439228
N-(2-amino-2-oxoethyl)-1-(4-fluorophenyl)cyclobutane-1-carboxamide
CID 110473843
N-(6-amino-3-pyridinyl)-1-(4-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119516222
N-(4-bromophenyl)-1-(4-fluorophenyl)cyclobutane-1-carboxamide
CID 110439174
1-(4-fluorophenyl)-N-(2-methylpropyl)cyclobutane-1-carboxamide
CID 110438203
N-[[1-(4-fluorophenyl)cyclopentyl]methyl]pyrazine-2-carboxamide
CID 47042253
1-(4-fluorophenyl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclobutane-1-carboxamide
CID 60580980

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide?
The IUPAC name of 1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide (CID 91644069) is 1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide.
What is the SMILES notation for 1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide?
The canonical SMILES for 1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide is O=C(NNc1cnccn1)C1(c2ccc(F)cc2)CCC1.
What is the InChIKey of 1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide?
The InChIKey is YAWFXAVCWNRYNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN4O/c16-12-4-2-11(3-5-12)15(6-1-7-15)14(21)20-19-13-10-17-8-9-18-13/h2-5,8-10H,1,6-7H2,(H,18,19)(H,20,21).
What are the key properties of 1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide?
1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide has a molecular weight of 286.31 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N'-pyrazin-2-ylcyclobutane-1-carbohydrazide is sourced from PubChem (CID 91644069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).