2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide

C20H30N2O3 — CID 111427408

IUPAC2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide
SMILESCC1CCN(CC(O)CNC(=O)c2ccccc2OC2CCC2)CC1
InChIInChI=1S/C20H30N2O3/c1-15-9-11-22(12-10-15)14-16(23)13-21-20(24)18-7-2-3-8-19(18)25-17-5-4-6-17/h2-3,7-8,15-17,23H,4-6,9-14H2,1H3,(H,21,24)
InChIKeyCYFCTHXDGDDCHL-UHFFFAOYSA-N
MW346.47 g/mol
LogP2.44
Rot. Bonds7

About 2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide

2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide (PubChem CID 111427408) has the molecular formula C20H30N2O3 and a molecular weight of 346.47 g/mol. Its IUPAC name is 2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide.

Molecular Properties

Compound Name2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide
PubChem CID111427408
Molecular FormulaC20H30N2O3
Molecular Weight346.47 g/mol
Exact Mass346.23
IUPAC Name2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide
SMILESCC1CCN(CC(O)CNC(=O)c2ccccc2OC2CCC2)CC1
InChIInChI=1S/C20H30N2O3/c1-15-9-11-22(12-10-15)14-16(23)13-21-20(24)18-7-2-3-8-19(18)25-17-5-4-6-17/h2-3,7-8,15-17,23H,4-6,9-14H2,1H3,(H,21,24)
InChIKeyCYFCTHXDGDDCHL-UHFFFAOYSA-N
XLogP2.44
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclohexyloxy-N-(2-hydroxypropyl)benzamide
CID 110466231
2,4-dichloro-N-[(2S)-2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide
CID 95304469
2-cyclobutyloxy-N-[2-(2-fluorophenyl)-2-hydroxyethyl]benzamide
CID 111565849
N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-2-oxochromene-3-carboxamide
CID 111112743
2-cyclobutyloxy-N-(3-hydroxybutyl)benzamide
CID 111433576
4-acetyl-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide
CID 111422376
N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-4-methylbenzamide
CID 111112795
N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]thiophene-2-carboxamide
CID 111112713
N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-1,2-oxazole-3-carboxamide
CID 111422396
N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-6-methylpyridine-2-carboxamide
CID 111112729
N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-1-methylindole-2-carboxamide
CID 111112721
N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-5-methylquinoline-8-carboxamide
CID 138053853

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide?
The IUPAC name of 2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide (CID 111427408) is 2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide.
What is the SMILES notation for 2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide?
The canonical SMILES for 2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide is CC1CCN(CC(O)CNC(=O)c2ccccc2OC2CCC2)CC1.
What is the InChIKey of 2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide?
The InChIKey is CYFCTHXDGDDCHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O3/c1-15-9-11-22(12-10-15)14-16(23)13-21-20(24)18-7-2-3-8-19(18)25-17-5-4-6-17/h2-3,7-8,15-17,23H,4-6,9-14H2,1H3,(H,21,24).
What are the key properties of 2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide?
2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide has a molecular weight of 346.47 g/mol, XLogP of 2.44, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyloxy-N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]benzamide is sourced from PubChem (CID 111427408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).