2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide

C14H20N2O — CID 124516930

IUPAC2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide
SMILESCc1ccccc1C(=O)N[C@@H]1CCNC[C@H]1C
InChIInChI=1S/C14H20N2O/c1-10-5-3-4-6-12(10)14(17)16-13-7-8-15-9-11(13)2/h3-6,11,13,15H,7-9H2,1-2H3,(H,16,17)/t11-,13-/m1/s1
InChIKeyPWYNMVCKSQNNIZ-DGCLKSJQSA-N
MW232.33 g/mol
LogP1.72
Rot. Bonds2

About 2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide

2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide (PubChem CID 124516930) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide
PubChem CID124516930
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide
SMILESCc1ccccc1C(=O)N[C@@H]1CCNC[C@H]1C
InChIInChI=1S/C14H20N2O/c1-10-5-3-4-6-12(10)14(17)16-13-7-8-15-9-11(13)2/h3-6,11,13,15H,7-9H2,1-2H3,(H,16,17)/t11-,13-/m1/s1
InChIKeyPWYNMVCKSQNNIZ-DGCLKSJQSA-N
XLogP1.72
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-3-methyl-N-(3-methylpiperidin-4-yl)benzamide
CID 81480777
4-bromo-2-methyl-N-(3-methylpiperidin-4-yl)benzamide
CID 120554553
2-(4-methylbenzoyl)-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120553364
2-benzamido-N-(3-methylpiperidin-4-yl)benzamide
CID 120557141
2-methyl-N-[(1R,2S)-2-methylcyclohexyl]benzamide
CID 804412
4-methyl-N-(3-methylpiperidin-4-yl)thiophene-3-carboxamide
CID 120557568
2-(2-methylphenyl)-N-(3-methylpiperidin-4-yl)acetamide;hydrochloride
CID 120557156
2-methyl-N-(3-methylpiperidin-4-yl)-3-nitrobenzamide
CID 120556205
2-methyl-N-(3-methylpiperidin-4-yl)-3-nitrobenzamide;hydrochloride
CID 120556204
2-[2-(dimethylamino)ethoxy]-N-(3-methylpiperidin-4-yl)benzamide;dihydrochloride
CID 120557456
2-[(4-methylphenyl)sulfonylamino]-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120557218
2,3,4-trifluoro-N-(3-methylpiperidin-4-yl)benzamide
CID 79886711

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide?
The IUPAC name of 2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide (CID 124516930) is 2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide.
What is the SMILES notation for 2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide?
The canonical SMILES for 2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide is Cc1ccccc1C(=O)N[C@@H]1CCNC[C@H]1C.
What is the InChIKey of 2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide?
The InChIKey is PWYNMVCKSQNNIZ-DGCLKSJQSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10-5-3-4-6-12(10)14(17)16-13-7-8-15-9-11(13)2/h3-6,11,13,15H,7-9H2,1-2H3,(H,16,17)/t11-,13-/m1/s1.
What are the key properties of 2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide?
2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide has a molecular weight of 232.33 g/mol, XLogP of 1.72, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide is sourced from PubChem (CID 124516930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).