2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide

C14H20N2O3 — CID 58025543

IUPAC2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide
SMILESCOc1ccccc1C(=O)N[C@H]1CCNC[C@H]1OC
InChIInChI=1S/C14H20N2O3/c1-18-12-6-4-3-5-10(12)14(17)16-11-7-8-15-9-13(11)19-2/h3-6,11,13,15H,7-9H2,1-2H3,(H,16,17)/t11-,13+/m0/s1
InChIKeyYJIQLNLIPQVOPU-WCQYABFASA-N
MW264.32 g/mol
LogP0.80
Rot. Bonds4

About 2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide

2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide (PubChem CID 58025543) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide
PubChem CID58025543
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide
SMILESCOc1ccccc1C(=O)N[C@H]1CCNC[C@H]1OC
InChIInChI=1S/C14H20N2O3/c1-18-12-6-4-3-5-10(12)14(17)16-11-7-8-15-9-13(11)19-2/h3-6,11,13,15H,7-9H2,1-2H3,(H,16,17)/t11-,13+/m0/s1
InChIKeyYJIQLNLIPQVOPU-WCQYABFASA-N
XLogP0.80
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-piperidin-4-ylbenzamide
CID 16780894
2-ethoxy-N-[(4S)-4-methoxypyrrolidin-3-yl]benzamide
CID 43594205
5-chloro-N-[(3R,4S)-3-methoxypiperidin-4-yl]-2-phenoxybenzamide
CID 67928776
2-methoxy-N-[4-[(2-methoxybenzoyl)amino]cyclohexyl]benzamide
CID 1235931
N-(4-methoxypyrrolidin-3-yl)-2-(trifluoromethyl)benzamide
CID 74883319
2,3,4-trimethoxy-N-(3-methylpiperidin-4-yl)benzamide
CID 120558034
2-bromo-N-[(4S)-4-methoxypyrrolidin-3-yl]-3-methylbenzamide
CID 113357096
2,4-dimethoxy-N-[(3R,4S)-3-methylpiperidin-4-yl]benzamide
CID 124516888
N-[(3S,4S)-3-methoxypiperidin-4-yl]-3-(trifluoromethyl)benzamide
CID 54389521
2,4-dimethoxy-N-(4-methylpiperidin-3-yl)benzamide
CID 63326134
2-hydroxy-3-methoxy-N-piperidin-3-ylbenzamide
CID 24708250
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-methoxybenzamide;oxalic acid
CID 24834277

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide?
The IUPAC name of 2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide (CID 58025543) is 2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide.
What is the SMILES notation for 2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide?
The canonical SMILES for 2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide is COc1ccccc1C(=O)N[C@H]1CCNC[C@H]1OC.
What is the InChIKey of 2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide?
The InChIKey is YJIQLNLIPQVOPU-WCQYABFASA-N. The full InChI is InChI=1S/C14H20N2O3/c1-18-12-6-4-3-5-10(12)14(17)16-11-7-8-15-9-13(11)19-2/h3-6,11,13,15H,7-9H2,1-2H3,(H,16,17)/t11-,13+/m0/s1.
What are the key properties of 2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide?
2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide has a molecular weight of 264.32 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(3R,4S)-3-methoxypiperidin-4-yl]benzamide is sourced from PubChem (CID 58025543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).