2-methyl-4-(piperidin-4-ylmethoxy)benzamide

C14H20N2O2 — CID 81276896

IUPAC2-methyl-4-(piperidin-4-ylmethoxy)benzamide
SMILESCc1cc(OCC2CCNCC2)ccc1C(N)=O
InChIInChI=1S/C14H20N2O2/c1-10-8-12(2-3-13(10)14(15)17)18-9-11-4-6-16-7-5-11/h2-3,8,11,16H,4-7,9H2,1H3,(H2,15,17)
InChIKeyVBZVCGWGMVHTFO-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.47
Rot. Bonds4

About 2-methyl-4-(piperidin-4-ylmethoxy)benzamide

2-methyl-4-(piperidin-4-ylmethoxy)benzamide (PubChem CID 81276896) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-methyl-4-(piperidin-4-ylmethoxy)benzamide.

Molecular Properties

Compound Name2-methyl-4-(piperidin-4-ylmethoxy)benzamide
PubChem CID81276896
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-methyl-4-(piperidin-4-ylmethoxy)benzamide
SMILESCc1cc(OCC2CCNCC2)ccc1C(N)=O
InChIInChI=1S/C14H20N2O2/c1-10-8-12(2-3-13(10)14(15)17)18-9-11-4-6-16-7-5-11/h2-3,8,11,16H,4-7,9H2,1H3,(H2,15,17)
InChIKeyVBZVCGWGMVHTFO-UHFFFAOYSA-N
XLogP1.47
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3,4-dimethylphenoxy)methyl]piperidine;hydrochloride
CID 56831093
2-methyl-4-(piperidin-4-ylmethylamino)benzamide
CID 81279242
2-amino-1-[4-(piperidin-4-ylmethoxy)phenyl]ethanone
CID 170861083
2-methyl-4-(oxan-4-ylmethoxy)benzoic acid
CID 81282466
2-amino-5-(cyclopropylmethoxy)benzamide
CID 61305267
(3S)-3-[(3,4-dimethylphenoxy)methyl]pyrrolidine
CID 86321220
5-chloro-2-(piperidin-4-ylmethoxy)benzamide
CID 62493382
2-chloro-4-(piperidin-3-ylmethoxy)benzamide
CID 62944251
2-methyl-4-(2-piperidin-2-ylethoxy)benzamide
CID 81276506
2,3-dimethyl-6-(piperidin-4-ylmethoxy)quinoxaline
CID 82189775
[4-(piperidin-4-ylmethoxy)phenyl] 2,2-dimethylpropanoate
CID 175326485
ethyl 3-[2-methyl-4-(pyrrolidin-3-ylmethoxy)phenyl]propanoate;hydrochloride
CID 164576692

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(piperidin-4-ylmethoxy)benzamide?
The IUPAC name of 2-methyl-4-(piperidin-4-ylmethoxy)benzamide (CID 81276896) is 2-methyl-4-(piperidin-4-ylmethoxy)benzamide.
What is the SMILES notation for 2-methyl-4-(piperidin-4-ylmethoxy)benzamide?
The canonical SMILES for 2-methyl-4-(piperidin-4-ylmethoxy)benzamide is Cc1cc(OCC2CCNCC2)ccc1C(N)=O.
What is the InChIKey of 2-methyl-4-(piperidin-4-ylmethoxy)benzamide?
The InChIKey is VBZVCGWGMVHTFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10-8-12(2-3-13(10)14(15)17)18-9-11-4-6-16-7-5-11/h2-3,8,11,16H,4-7,9H2,1H3,(H2,15,17).
What are the key properties of 2-methyl-4-(piperidin-4-ylmethoxy)benzamide?
2-methyl-4-(piperidin-4-ylmethoxy)benzamide has a molecular weight of 248.33 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(piperidin-4-ylmethoxy)benzamide is sourced from PubChem (CID 81276896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).