N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide

C18H28N2O2 — CID 142170348

IUPACN-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide
SMILESCN1CCC(c2ccc(CCCCCC(=O)NO)cc2)CC1
InChIInChI=1S/C18H28N2O2/c1-20-13-11-17(12-14-20)16-9-7-15(8-10-16)5-3-2-4-6-18(21)19-22/h7-10,17,22H,2-6,11-14H2,1H3,(H,19,21)
InChIKeyASMXMECFKRPJFZ-UHFFFAOYSA-N
MW304.43 g/mol
LogP3.10
Rot. Bonds7

About N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide

N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide (PubChem CID 142170348) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide.

Molecular Properties

Compound NameN-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide
PubChem CID142170348
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC NameN-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide
SMILESCN1CCC(c2ccc(CCCCCC(=O)NO)cc2)CC1
InChIInChI=1S/C18H28N2O2/c1-20-13-11-17(12-14-20)16-9-7-15(8-10-16)5-3-2-4-6-18(21)19-22/h7-10,17,22H,2-6,11-14H2,1H3,(H,19,21)
InChIKeyASMXMECFKRPJFZ-UHFFFAOYSA-N
XLogP3.10
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[4-(1-methylpiperidin-4-yl)phenyl]butanoic acid
CID 117408104
[4-(1-methylpiperidin-4-yl)phenyl]methanol
CID 58229057
6-[4-(4-ethylphenyl)phenyl]-N-hydroxyhexanamide
CID 142170347
1,13-bis[4-(4-propylcyclohexyl)phenyl]tridecan-7-one
CID 70445108
N-hydroxy-6-[4-[4-(piperidin-1-ylmethyl)phenyl]phenyl]hexanamide
CID 142052359
N-(1-methylpiperidin-4-yl)-4-phenylbutanamide
CID 2971184
1-[4-(1-methylpiperidin-4-yl)phenyl]pentan-1-one
CID 101453044
N-hydroxy-6-phenylhexanamide;thiohydroxylamine
CID 142086803
3-[4-(1-methylpyrrolidin-3-yl)phenyl]propan-1-amine
CID 84786356
1,9-bis[4-(4-propanoylcyclohexyl)phenyl]nonan-5-one
CID 70444310
2-[4-(1-methylpyrrolidin-3-yl)phenyl]ethanol
CID 84778677
4-(4-bromophenyl)-N-hydroxybutanamide
CID 139305557

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide?
The IUPAC name of N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide (CID 142170348) is N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide.
What is the SMILES notation for N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide?
The canonical SMILES for N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide is CN1CCC(c2ccc(CCCCCC(=O)NO)cc2)CC1.
What is the InChIKey of N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide?
The InChIKey is ASMXMECFKRPJFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-20-13-11-17(12-14-20)16-9-7-15(8-10-16)5-3-2-4-6-18(21)19-22/h7-10,17,22H,2-6,11-14H2,1H3,(H,19,21).
What are the key properties of N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide?
N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide has a molecular weight of 304.43 g/mol, XLogP of 3.10, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-6-[4-(1-methylpiperidin-4-yl)phenyl]hexanamide is sourced from PubChem (CID 142170348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).