2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide

C14H18N2O3 — CID 19916735

IUPAC2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide
SMILESCC1CCCC/C1=N/NC(=O)c1ccc(O)cc1O
InChIInChI=1S/C14H18N2O3/c1-9-4-2-3-5-12(9)15-16-14(19)11-7-6-10(17)8-13(11)18/h6-9,17-18H,2-5H2,1H3,(H,16,19)/b15-12-
InChIKeyPOBGRGCPLLNADS-QINSGFPZSA-N
MW262.31 g/mol
LogP2.39
Rot. Bonds2

About 2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide

2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide (PubChem CID 19916735) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide.

Molecular Properties

Compound Name2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide
PubChem CID19916735
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide
SMILESCC1CCCC/C1=N/NC(=O)c1ccc(O)cc1O
InChIInChI=1S/C14H18N2O3/c1-9-4-2-3-5-12(9)15-16-14(19)11-7-6-10(17)8-13(11)18/h6-9,17-18H,2-5H2,1H3,(H,16,19)/b15-12-
InChIKeyPOBGRGCPLLNADS-QINSGFPZSA-N
XLogP2.39
TPSA81.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 52.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2,5-dihydroxy-N-[(E)-[(2S)-2-methylcyclohexylidene]amino]benzamide
CID 98299823
2-hydroxy-N-[[(2S)-2-methylcyclohexylidene]amino]benzamide
CID 129360183
3-chloro-N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]benzamide
CID 7722671
[(Z)-(2-methylcyclohexylidene)amino]urea
CID 5374162
N'-[(Z)-[(2S)-2-methylcyclohexylidene]amino]-N-propan-2-yloxamide
CID 9351584
2,5-dihydroxy-N-[(E)-[(3R)-3-methylcyclohexylidene]amino]benzamide
CID 27459585
2,4-dihydroxy-N-(2-methylcycloheptyl)benzamide
CID 103714355
4-ethoxy-N-[(E)-(2-methylcyclohexylidene)amino]benzamide
CID 6381697
2-(furan-2-yl)-N-[[(2S)-2-methylcyclohexylidene]amino]quinoline-4-carboxamide
CID 9214481
N-[(Z)-[(2R)-2-methylcyclohexylidene]amino]-4-(phenoxymethyl)benzamide
CID 8518251
2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide
CID 103612467
1-methyl-3-[(Z)-(2-methylcyclohexylidene)amino]thiourea
CID 6380013

Frequently Asked Questions

What is the IUPAC name of 2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide?
The IUPAC name of 2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide (CID 19916735) is 2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide.
What is the SMILES notation for 2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide?
The canonical SMILES for 2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide is CC1CCCC/C1=N/NC(=O)c1ccc(O)cc1O.
What is the InChIKey of 2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide?
The InChIKey is POBGRGCPLLNADS-QINSGFPZSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-9-4-2-3-5-12(9)15-16-14(19)11-7-6-10(17)8-13(11)18/h6-9,17-18H,2-5H2,1H3,(H,16,19)/b15-12-.
What are the key properties of 2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide?
2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide has a molecular weight of 262.31 g/mol, XLogP of 2.39, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dihydroxy-N-[(Z)-(2-methylcyclohexylidene)amino]benzamide is sourced from PubChem (CID 19916735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).