N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide

C19H30N2O2 — CID 99834501

IUPACN-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide
SMILESCC(C)(O)C(=O)NC1CCN(c2ccc(C(C)(C)C)cc2)CC1
InChIInChI=1S/C19H30N2O2/c1-18(2,3)14-6-8-16(9-7-14)21-12-10-15(11-13-21)20-17(22)19(4,5)23/h6-9,15,23H,10-13H2,1-5H3,(H,20,22)
InChIKeyVVQBJENGIKBRHJ-UHFFFAOYSA-N
MW318.46 g/mol
LogP2.84
Rot. Bonds3

About N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide

N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide (PubChem CID 99834501) has the molecular formula C19H30N2O2 and a molecular weight of 318.46 g/mol. Its IUPAC name is N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide.

Molecular Properties

Compound NameN-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide
PubChem CID99834501
Molecular FormulaC19H30N2O2
Molecular Weight318.46 g/mol
Exact Mass318.23
IUPAC NameN-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide
SMILESCC(C)(O)C(=O)NC1CCN(c2ccc(C(C)(C)C)cc2)CC1
InChIInChI=1S/C19H30N2O2/c1-18(2,3)14-6-8-16(9-7-14)21-12-10-15(11-13-21)20-17(22)19(4,5)23/h6-9,15,23H,10-13H2,1-5H3,(H,20,22)
InChIKeyVVQBJENGIKBRHJ-UHFFFAOYSA-N
XLogP2.84
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-methylpropanamide;dihydrochloride
CID 119862908
N-[1-(4-tert-butylphenyl)piperidin-4-yl]-4-hydroxypyrrolidine-2-carboxamide;dihydrochloride
CID 119862926
2-amino-2-phenyl-N-(1-phenylpiperidin-4-yl)propanamide
CID 120595916
3-amino-N-[1-(4-tert-butylphenyl)piperidin-4-yl]benzamide
CID 119862941
N-[1-(4-tert-butylphenyl)piperidin-4-yl]-3-piperidin-4-ylbutanamide;dihydrochloride
CID 119862946
4-[[[1-(4-tert-butylphenyl)piperidin-4-yl]amino]methyl]benzoic acid
CID 122030606
3-amino-N-[1-(4-tert-butylphenyl)piperidin-4-yl]-3-phenylpropanamide;dihydrochloride
CID 119953381
N-[1-(4-tert-butylphenyl)piperidin-4-yl]-4-methoxypiperidine-4-carboxamide;dihydrochloride
CID 119862948
N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-cyclopropyl-1,3-thiazole-5-carboxamide
CID 86891667
N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-[2-(methanesulfonamido)phenyl]acetamide
CID 86935166
3-hydroxy-3-phenyl-N-(1-phenylpiperidin-4-yl)butanamide
CID 86785833
2-(aminomethyl)-N-[1-(4-tert-butylphenyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide
CID 119862945

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide?
The IUPAC name of N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide (CID 99834501) is N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide.
What is the SMILES notation for N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide?
The canonical SMILES for N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide is CC(C)(O)C(=O)NC1CCN(c2ccc(C(C)(C)C)cc2)CC1.
What is the InChIKey of N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide?
The InChIKey is VVQBJENGIKBRHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2/c1-18(2,3)14-6-8-16(9-7-14)21-12-10-15(11-13-21)20-17(22)19(4,5)23/h6-9,15,23H,10-13H2,1-5H3,(H,20,22).
What are the key properties of N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide?
N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide has a molecular weight of 318.46 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-hydroxy-2-methylpropanamide is sourced from PubChem (CID 99834501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).