N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide

C17H24N2O3 — CID 108558809

IUPACN-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC1CCN(C(=O)c2ccccc2O)CC1
InChIInChI=1S/C17H24N2O3/c1-17(2,3)16(22)18-12-8-10-19(11-9-12)15(21)13-6-4-5-7-14(13)20/h4-7,12,20H,8-11H2,1-3H3,(H,18,22)
InChIKeyBSUVWGHOJLGOIV-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.16
Rot. Bonds2

About N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide

N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide (PubChem CID 108558809) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide
PubChem CID108558809
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC1CCN(C(=O)c2ccccc2O)CC1
InChIInChI=1S/C17H24N2O3/c1-17(2,3)16(22)18-12-8-10-19(11-9-12)15(21)13-6-4-5-7-14(13)20/h4-7,12,20H,8-11H2,1-3H3,(H,18,22)
InChIKeyBSUVWGHOJLGOIV-UHFFFAOYSA-N
XLogP2.16
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[1-(2-hydroxybenzoyl)piperidin-4-yl]propanamide
CID 108564395
2-fluoro-N-[1-(2-hydroxybenzoyl)piperidin-4-yl]benzamide
CID 108549339
2,2-dimethyl-N-[1-(thiophene-2-carbonyl)piperidin-4-yl]propanamide
CID 110820141
N-[1-[2-[4-[3-(dimethylamino)propyl]piperazine-1-carbonyl]phenyl]piperidin-4-yl]-2,2-dimethylpropanamide
CID 46038383
4-tert-butyl-N-[1-(2-hydroxybenzoyl)piperidin-4-yl]benzenesulfonamide
CID 108564360
2,2,2-trifluoro-N-[1-(2-iodobenzoyl)piperidin-4-yl]acetamide
CID 108548674
2,2-dimethyl-N-[1-[2-(4-pyridin-2-ylpiperazine-1-carbonyl)phenyl]piperidin-4-yl]propanamide
CID 46038347
4-(2-hydroxybenzoyl)-N-(1-propylpiperidin-4-yl)piperazine-1-carboxamide
CID 127294442
1-[1-(2-hydroxybenzoyl)piperidin-4-yl]-3-[(2R)-1-methoxypropan-2-yl]urea
CID 95772650
N-[1-[2-(2-fluorophenyl)acetyl]piperidin-4-yl]-2,2-dimethylpropanamide
CID 110822805
N-[1-(3,5-dihydroxybenzoyl)piperidin-4-yl]-2-hydroxybenzamide
CID 108551443
tert-butyl N-[1-[2-(2-hydroxyphenyl)-2-oxoacetyl]piperidin-4-yl]carbamate
CID 167977498

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide?
The IUPAC name of N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide (CID 108558809) is N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)NC1CCN(C(=O)c2ccccc2O)CC1.
What is the InChIKey of N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide?
The InChIKey is BSUVWGHOJLGOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-17(2,3)16(22)18-12-8-10-19(11-9-12)15(21)13-6-4-5-7-14(13)20/h4-7,12,20H,8-11H2,1-3H3,(H,18,22).
What are the key properties of N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide?
N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide has a molecular weight of 304.39 g/mol, XLogP of 2.16, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2,2-dimethylpropanamide is sourced from PubChem (CID 108558809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).