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

C20H32N2O2 — CID 51941744

IUPAC3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
SMILESCOCc1cccc(C(=O)NC[C@@H](C(C)C)N2CCC(C)CC2)c1
InChIInChI=1S/C20H32N2O2/c1-15(2)19(22-10-8-16(3)9-11-22)13-21-20(23)18-7-5-6-17(12-18)14-24-4/h5-7,12,15-16,19H,8-11,13-14H2,1-4H3,(H,21,23)/t19-/m0/s1
InChIKeyACIIRWOSEKFXCO-IBGZPJMESA-N
MW332.49 g/mol
LogP3.32
Rot. Bonds7

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

3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide (PubChem CID 51941744) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is 3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide.

Molecular Properties

Compound Name3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
PubChem CID51941744
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC Name3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
SMILESCOCc1cccc(C(=O)NC[C@@H](C(C)C)N2CCC(C)CC2)c1
InChIInChI=1S/C20H32N2O2/c1-15(2)19(22-10-8-16(3)9-11-22)13-21-20(23)18-7-5-6-17(12-18)14-24-4/h5-7,12,15-16,19H,8-11,13-14H2,1-4H3,(H,21,23)/t19-/m0/s1
InChIKeyACIIRWOSEKFXCO-IBGZPJMESA-N
XLogP3.32
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
CID 119849842
3-[methoxy(methyl)sulfamoyl]-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
CID 55658978
3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide
CID 100850955
N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 60510665
3-methoxy-N-(3-methyl-2-pyrrolidin-1-ylbutyl)benzamide
CID 110402974
3,5-diacetamido-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
CID 55658240
2-hydroxy-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
CID 39111251
2-amino-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
CID 119946551
methyl 2-hydroxy-3-[[3-(methoxymethyl)benzoyl]amino]propanoate
CID 103879076
2-(4-aminophenyl)-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide;dihydrochloride
CID 119849811
N-[2-(4-methylpiperidin-1-yl)propyl]benzamide
CID 112502434
N-[4-[[3-methyl-2-(4-methylpiperidin-1-yl)butyl]carbamoyl]phenyl]pyridine-4-carboxamide
CID 56808571

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide?
The IUPAC name of 3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide (CID 51941744) is 3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide.
What is the SMILES notation for 3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide?
The canonical SMILES for 3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide is COCc1cccc(C(=O)NC[C@@H](C(C)C)N2CCC(C)CC2)c1.
What is the InChIKey of 3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide?
The InChIKey is ACIIRWOSEKFXCO-IBGZPJMESA-N. The full InChI is InChI=1S/C20H32N2O2/c1-15(2)19(22-10-8-16(3)9-11-22)13-21-20(23)18-7-5-6-17(12-18)14-24-4/h5-7,12,15-16,19H,8-11,13-14H2,1-4H3,(H,21,23)/t19-/m0/s1.
What are the key properties of 3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide?
3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide has a molecular weight of 332.49 g/mol, XLogP of 3.32, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide is sourced from PubChem (CID 51941744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).