2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide

C18H28N2O2 — CID 39111251

IUPAC2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
SMILESCC1CCN([C@@H](CNC(=O)c2ccccc2O)C(C)C)CC1
InChIInChI=1S/C18H28N2O2/c1-13(2)16(20-10-8-14(3)9-11-20)12-19-18(22)15-6-4-5-7-17(15)21/h4-7,13-14,16,21H,8-12H2,1-3H3,(H,19,22)/t16-/m0/s1
InChIKeyIVGWWNBWWLUUHR-INIZCTEOSA-N
MW304.43 g/mol
LogP2.88
Rot. Bonds5

About 2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide

2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide (PubChem CID 39111251) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is 2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
PubChem CID39111251
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC Name2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
SMILESCC1CCN([C@@H](CNC(=O)c2ccccc2O)C(C)C)CC1
InChIInChI=1S/C18H28N2O2/c1-13(2)16(20-10-8-14(3)9-11-20)12-19-18(22)15-6-4-5-7-17(15)21/h4-7,13-14,16,21H,8-12H2,1-3H3,(H,19,22)/t16-/m0/s1
InChIKeyIVGWWNBWWLUUHR-INIZCTEOSA-N
XLogP2.88
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
CID 119946551
2-chloro-N-[2-[[3-methyl-2-(4-methylpiperidin-1-yl)butyl]amino]-2-oxoethyl]benzamide
CID 55658916
3-amino-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
CID 119849842
2-methyl-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]-4-nitrobenzamide
CID 60616193
2-(4-aminophenyl)-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide;dihydrochloride
CID 119849811
N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 39113519
N-[(2S)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]-2-(2-nitrophenyl)acetamide
CID 51941754
2-iodo-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]-4-nitrobenzamide
CID 60621704
2-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)benzamide
CID 110402733
3,5-diacetamido-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
CID 55658240
3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
CID 51941744
2-amino-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide
CID 119849844

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide?
The IUPAC name of 2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide (CID 39111251) is 2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide.
What is the SMILES notation for 2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide?
The canonical SMILES for 2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide is CC1CCN([C@@H](CNC(=O)c2ccccc2O)C(C)C)CC1.
What is the InChIKey of 2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide?
The InChIKey is IVGWWNBWWLUUHR-INIZCTEOSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-13(2)16(20-10-8-14(3)9-11-20)12-19-18(22)15-6-4-5-7-17(15)21/h4-7,13-14,16,21H,8-12H2,1-3H3,(H,19,22)/t16-/m0/s1.
What are the key properties of 2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide?
2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide has a molecular weight of 304.43 g/mol, XLogP of 2.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide is sourced from PubChem (CID 39111251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).