3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide

C18H28N2O2 — CID 100850955

IUPAC3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide
SMILESCOCc1cccc(C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)c1
InChIInChI=1S/C18H28N2O2/c1-14-6-5-9-20(12-14)15(2)11-19-18(21)17-8-4-7-16(10-17)13-22-3/h4,7-8,10,14-15H,5-6,9,11-13H2,1-3H3,(H,19,21)/t14-,15-/m1/s1
InChIKeyHBXKFYGLEZVHBB-HUUCEWRRSA-N
MW304.43 g/mol
LogP2.68
Rot. Bonds6

About 3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide

3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide (PubChem CID 100850955) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is 3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide.

Molecular Properties

Compound Name3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide
PubChem CID100850955
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC Name3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide
SMILESCOCc1cccc(C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)c1
InChIInChI=1S/C18H28N2O2/c1-14-6-5-9-20(12-14)15(2)11-19-18(21)17-8-4-7-16(10-17)13-22-3/h4,7-8,10,14-15H,5-6,9,11-13H2,1-3H3,(H,19,21)/t14-,15-/m1/s1
InChIKeyHBXKFYGLEZVHBB-HUUCEWRRSA-N
XLogP2.68
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[2-(3-methylpiperidin-1-yl)propyl]benzamide
CID 119850765
3-(methoxymethyl)-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]benzamide
CID 51941744
4-bromo-3,5-dimethoxy-N-[2-(3-methylpiperidin-1-yl)propyl]benzamide
CID 55717834
2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide
CID 47036184
2-bromo-N-[2-(3-methylpiperidin-1-yl)propyl]benzamide
CID 47036181
N,N-dimethyl-3-[2-[[N'-methyl-N-[2-(3-methylpiperidin-1-yl)propyl]carbamimidoyl]amino]ethyl]benzamide
CID 111668870
2-amino-N-[2-(3-methylpiperidin-1-yl)propyl]benzamide;dihydrochloride
CID 119946563
N-[(1-hydroxy-3-methylcyclohexyl)methyl]-3-(methoxymethyl)benzamide
CID 65124255
methyl 2-hydroxy-3-[[3-(methoxymethyl)benzoyl]amino]propanoate
CID 103879076
2-chloro-4-fluoro-N-[(2R)-2-[(3S)-3-methylpiperidin-1-yl]propyl]benzamide
CID 98720791
2-chloro-4-fluoro-N-[2-(3-methylpiperidin-1-yl)propyl]benzamide
CID 47036175
1-[[3-(methoxymethyl)phenyl]methyl]-3-[(2S)-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]urea
CID 100840376

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide?
The IUPAC name of 3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide (CID 100850955) is 3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide.
What is the SMILES notation for 3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide?
The canonical SMILES for 3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide is COCc1cccc(C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)c1.
What is the InChIKey of 3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide?
The InChIKey is HBXKFYGLEZVHBB-HUUCEWRRSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-14-6-5-9-20(12-14)15(2)11-19-18(21)17-8-4-7-16(10-17)13-22-3/h4,7-8,10,14-15H,5-6,9,11-13H2,1-3H3,(H,19,21)/t14-,15-/m1/s1.
What are the key properties of 3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide?
3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide has a molecular weight of 304.43 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide is sourced from PubChem (CID 100850955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).