4-butyl-N'-hydroxybenzenecarboximidamide

C11H16N2O — CID 7018220

IUPAC4-butyl-N'-hydroxybenzenecarboximidamide
SMILESCCCCc1ccc(/C(N)=N/O)cc1
InChIInChI=1S/C11H16N2O/c1-2-3-4-9-5-7-10(8-6-9)11(12)13-14/h5-8,14H,2-4H2,1H3,(H2,12,13)
InChIKeyLNSILFGWSYOPRX-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.12
Rot. Bonds4

About 4-butyl-N'-hydroxybenzenecarboximidamide

4-butyl-N'-hydroxybenzenecarboximidamide (PubChem CID 7018220) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 4-butyl-N'-hydroxybenzenecarboximidamide.

Molecular Properties

Compound Name4-butyl-N'-hydroxybenzenecarboximidamide
PubChem CID7018220
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name4-butyl-N'-hydroxybenzenecarboximidamide
SMILESCCCCc1ccc(/C(N)=N/O)cc1
InChIInChI=1S/C11H16N2O/c1-2-3-4-9-5-7-10(8-6-9)11(12)13-14/h5-8,14H,2-4H2,1H3,(H2,12,13)
InChIKeyLNSILFGWSYOPRX-UHFFFAOYSA-N
XLogP2.12
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(butoxymethyl)-N'-hydroxybenzenecarboximidamide
CID 43267729
4-[2-(4-butylphenyl)ethyl]-N'-hydroxy-3-(trifluoromethyl)benzenecarboximidamide
CID 121256791
4-butoxy-N'-hydroxybenzenecarboximidamide
CID 2255598
2-(4-butylphenoxy)-N'-hydroxybenzenecarboximidamide
CID 115492682
1-[4-(4-butylphenyl)phenyl]ethenamine
CID 166698710
N-hydroxy-4-pentylbenzenecarboximidoyl chloride
CID 145299970
1-butyl-4-[3-(4-butylphenyl)buta-1,3-dien-2-yl]benzene
CID 122396068
4-[(2-butoxyethylamino)methyl]-N'-hydroxybenzenecarboximidamide
CID 77031227
N'-hydroxy-4-(2-methylpropyl)benzenecarboximidamide
CID 96670524
4-[[ethyl(methyl)amino]methyl]-N'-hydroxybenzenecarboximidamide
CID 43263456
4-(4-butylphenyl)-4-oxobutanamide
CID 47319697
N'-hydroxy-4-[4-(2-hydroxyethyl)phenoxy]benzenecarboximidamide
CID 107708950

Frequently Asked Questions

What is the IUPAC name of 4-butyl-N'-hydroxybenzenecarboximidamide?
The IUPAC name of 4-butyl-N'-hydroxybenzenecarboximidamide (CID 7018220) is 4-butyl-N'-hydroxybenzenecarboximidamide.
What is the SMILES notation for 4-butyl-N'-hydroxybenzenecarboximidamide?
The canonical SMILES for 4-butyl-N'-hydroxybenzenecarboximidamide is CCCCc1ccc(/C(N)=N/O)cc1.
What is the InChIKey of 4-butyl-N'-hydroxybenzenecarboximidamide?
The InChIKey is LNSILFGWSYOPRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-2-3-4-9-5-7-10(8-6-9)11(12)13-14/h5-8,14H,2-4H2,1H3,(H2,12,13).
What are the key properties of 4-butyl-N'-hydroxybenzenecarboximidamide?
4-butyl-N'-hydroxybenzenecarboximidamide has a molecular weight of 192.26 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-N'-hydroxybenzenecarboximidamide is sourced from PubChem (CID 7018220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).