2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide

C19H20N2O3 — CID 87468698

IUPAC2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide
SMILESNC(=O)c1cccc(-c2ccc(C(=O)NO)cc2)c1C1CCCC1
InChIInChI=1S/C19H20N2O3/c20-18(22)16-7-3-6-15(17(16)13-4-1-2-5-13)12-8-10-14(11-9-12)19(23)21-24/h3,6-11,13,24H,1-2,4-5H2,(H2,20,22)(H,21,23)
InChIKeyBLFBPFXVDCBITK-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.23
Rot. Bonds4

About 2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide

2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide (PubChem CID 87468698) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is 2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide
PubChem CID87468698
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide
SMILESNC(=O)c1cccc(-c2ccc(C(=O)NO)cc2)c1C1CCCC1
InChIInChI=1S/C19H20N2O3/c20-18(22)16-7-3-6-15(17(16)13-4-1-2-5-13)12-8-10-14(11-9-12)19(23)21-24/h3,6-11,13,24H,1-2,4-5H2,(H2,20,22)(H,21,23)
InChIKeyBLFBPFXVDCBITK-UHFFFAOYSA-N
XLogP3.23
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide?
The IUPAC name of 2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide (CID 87468698) is 2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide.
What is the SMILES notation for 2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide?
The canonical SMILES for 2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide is NC(=O)c1cccc(-c2ccc(C(=O)NO)cc2)c1C1CCCC1.
What is the InChIKey of 2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide?
The InChIKey is BLFBPFXVDCBITK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c20-18(22)16-7-3-6-15(17(16)13-4-1-2-5-13)12-8-10-14(11-9-12)19(23)21-24/h3,6-11,13,24H,1-2,4-5H2,(H2,20,22)(H,21,23).
What are the key properties of 2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide?
2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide has a molecular weight of 324.38 g/mol, XLogP of 3.23, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-3-[4-(hydroxycarbamoyl)phenyl]benzamide is sourced from PubChem (CID 87468698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).