N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide

C17H24N2O3 — CID 52918058

IUPACN-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide
SMILESO=C(CCCC1CCN(C(=O)Cc2ccccc2)CC1)NO
InChIInChI=1S/C17H24N2O3/c20-16(18-22)8-4-7-14-9-11-19(12-10-14)17(21)13-15-5-2-1-3-6-15/h1-3,5-6,14,22H,4,7-13H2,(H,18,20)
InChIKeyBTBHLVARBASTIO-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.14
Rot. Bonds6

About N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide

N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide (PubChem CID 52918058) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide.

Molecular Properties

Compound NameN-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide
PubChem CID52918058
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide
SMILESO=C(CCCC1CCN(C(=O)Cc2ccccc2)CC1)NO
InChIInChI=1S/C17H24N2O3/c20-16(18-22)8-4-7-14-9-11-19(12-10-14)17(21)13-15-5-2-1-3-6-15/h1-3,5-6,14,22H,4,7-13H2,(H,18,20)
InChIKeyBTBHLVARBASTIO-UHFFFAOYSA-N
XLogP2.14
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.14
H-Bond Donors ≤ 52
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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Related Compounds

4-[1-[(3S)-3-amino-5-phenylpentanoyl]piperidin-4-yl]-N-hydroxybutanamide
CID 87749504
4-[1-[(3R)-3-amino-5-phenylpentanoyl]piperidin-4-yl]-N-hydroxybutanamide
CID 87749494
2-[1-(2-phenylacetyl)piperidin-4-yl]acetic acid
CID 28997512
1-ethyl-3-[4-[1-(2-phenylacetyl)piperidin-4-yl]butyl]urea
CID 169317885
2-amino-4-[4-[4-(hydroxyamino)-4-oxobutyl]piperidin-1-yl]-N-(naphthalen-1-ylmethyl)-4-oxobutanamide
CID 73125115
4-[4-(hydroxyamino)-4-oxobutyl]-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide
CID 87747906
4-[4-(hydroxyamino)-4-oxobutyl]-N-[(2-methoxyphenyl)methyl]piperidine-1-carboxamide
CID 11849005
4-[1-[(2S)-2-(dimethylamino)-4-phenylbutyl]piperidin-4-yl]-N-hydroxybutanamide
CID 141152835
1-[3-(2-bromoethyl)pyrrolidin-1-yl]-2-phenylethanone
CID 114801701
2-chloro-1-[4-(3-phenylpropyl)piperidin-1-yl]ethanone
CID 19961796
2-phenyl-1-[4-[(4-phenylphenyl)methyl]piperidin-1-yl]ethanone
CID 24720516
4-[1-[3-amino-3-(3-fluorophenyl)propanoyl]piperidin-4-yl]-N-hydroxybutanamide
CID 87749330

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide?
The IUPAC name of N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide (CID 52918058) is N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide.
What is the SMILES notation for N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide?
The canonical SMILES for N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide is O=C(CCCC1CCN(C(=O)Cc2ccccc2)CC1)NO.
What is the InChIKey of N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide?
The InChIKey is BTBHLVARBASTIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c20-16(18-22)8-4-7-14-9-11-19(12-10-14)17(21)13-15-5-2-1-3-6-15/h1-3,5-6,14,22H,4,7-13H2,(H,18,20).
What are the key properties of N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide?
N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide has a molecular weight of 304.39 g/mol, XLogP of 2.14, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide is sourced from PubChem (CID 52918058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).