N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide

C14H20N2O — CID 1118538

IUPACN-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide
SMILESC[C@@H]1CCCN(CNC(=O)c2ccccc2)C1
InChIInChI=1S/C14H20N2O/c1-12-6-5-9-16(10-12)11-15-14(17)13-7-3-2-4-8-13/h2-4,7-8,12H,5-6,9-11H2,1H3,(H,15,17)/t12-/m1/s1
InChIKeyHGDMSNDOBJQNSW-GFCCVEGCSA-N
MW232.33 g/mol
LogP2.11
Rot. Bonds3

About N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide

N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide (PubChem CID 1118538) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide.

Molecular Properties

Compound NameN-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide
PubChem CID1118538
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide
SMILESC[C@@H]1CCCN(CNC(=O)c2ccccc2)C1
InChIInChI=1S/C14H20N2O/c1-12-6-5-9-16(10-12)11-15-14(17)13-7-3-2-4-8-13/h2-4,7-8,12H,5-6,9-11H2,1H3,(H,15,17)/t12-/m1/s1
InChIKeyHGDMSNDOBJQNSW-GFCCVEGCSA-N
XLogP2.11
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(3S)-3-methylpiperidin-1-yl]sulfonylethyl]benzamide
CID 7423212
4-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzene-1,4-dicarboxamide
CID 60556119
2-(3-methylpiperidin-1-yl)-1-(4-phenylphenyl)ethanone
CID 82051048
N-benzhydryl-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 2681889
3-bromo-N-[2-(3-methylpiperidin-1-yl)ethyl]benzamide
CID 47035917
3-amino-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide
CID 119845555
N-[4-(3-methylpiperidin-1-yl)butyl]naphthalene-2-carboxamide
CID 51115800
4-[[(3R)-3-methylpiperidin-1-yl]methyl]-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 99939718
4-[[(3S)-3-methylpiperidin-1-yl]methyl]-N-prop-2-enylbenzamide
CID 93490121
4-[(3-methylpiperidin-1-yl)methyl]-N-prop-2-enylbenzamide
CID 43918543
4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide
CID 109047837
N-[[2-[[(3S)-3-methylpiperidin-1-yl]methyl]phenyl]methyl]-4-(methylsulfonylmethyl)benzamide
CID 51947396

Frequently Asked Questions

What is the IUPAC name of N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide?
The IUPAC name of N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide (CID 1118538) is N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide.
What is the SMILES notation for N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide?
The canonical SMILES for N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide is C[C@@H]1CCCN(CNC(=O)c2ccccc2)C1.
What is the InChIKey of N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide?
The InChIKey is HGDMSNDOBJQNSW-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H20N2O/c1-12-6-5-9-16(10-12)11-15-14(17)13-7-3-2-4-8-13/h2-4,7-8,12H,5-6,9-11H2,1H3,(H,15,17)/t12-/m1/s1.
What are the key properties of N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide?
N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide has a molecular weight of 232.33 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(3R)-3-methylpiperidin-1-yl]methyl]benzamide is sourced from PubChem (CID 1118538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).