N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide

C16H22N2O2 — CID 58055632

IUPACN-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESO=C(NO)c1ccc2c(c1)CCC(C1CCNCC1)C2
InChIInChI=1S/C16H22N2O2/c19-16(18-20)15-4-3-13-9-12(1-2-14(13)10-15)11-5-7-17-8-6-11/h3-4,10-12,17,20H,1-2,5-9H2,(H,18,19)
InChIKeyZFJKPPBGGPFHTA-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.91
Rot. Bonds2

About N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide

N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide (PubChem CID 58055632) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide
PubChem CID58055632
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESO=C(NO)c1ccc2c(c1)CCC(C1CCNCC1)C2
InChIInChI=1S/C16H22N2O2/c19-16(18-20)15-4-3-13-9-12(1-2-14(13)10-15)11-5-7-17-8-6-11/h3-4,10-12,17,20H,1-2,5-9H2,(H,18,19)
InChIKeyZFJKPPBGGPFHTA-UHFFFAOYSA-N
XLogP1.91
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.91
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 N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The IUPAC name of N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide (CID 58055632) is N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide.
What is the SMILES notation for N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The canonical SMILES for N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide is O=C(NO)c1ccc2c(c1)CCC(C1CCNCC1)C2.
What is the InChIKey of N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The InChIKey is ZFJKPPBGGPFHTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c19-16(18-20)15-4-3-13-9-12(1-2-14(13)10-15)11-5-7-17-8-6-11/h3-4,10-12,17,20H,1-2,5-9H2,(H,18,19).
What are the key properties of N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide has a molecular weight of 274.36 g/mol, XLogP of 1.91, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-6-piperidin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide is sourced from PubChem (CID 58055632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).