3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide

C14H20N2O3 — CID 107705334

IUPAC3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide
SMILESCN(CC1CCCCN1)C(=O)c1cc(O)cc(O)c1
InChIInChI=1S/C14H20N2O3/c1-16(9-11-4-2-3-5-15-11)14(19)10-6-12(17)8-13(18)7-10/h6-8,11,15,17-18H,2-5,9H2,1H3
InChIKeyHYKIATMLOATBON-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.31
Rot. Bonds3

About 3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide

3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide (PubChem CID 107705334) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide
PubChem CID107705334
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide
SMILESCN(CC1CCCCN1)C(=O)c1cc(O)cc(O)c1
InChIInChI=1S/C14H20N2O3/c1-16(9-11-4-2-3-5-15-11)14(19)10-6-12(17)8-13(18)7-10/h6-8,11,15,17-18H,2-5,9H2,1H3
InChIKeyHYKIATMLOATBON-UHFFFAOYSA-N
XLogP1.31
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dichloro-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607655
3,4,5-trifluoro-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607828
N-methyl-N-(piperidin-2-ylmethyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 106627264
3-(dimethylamino)-N-methyl-N-(piperidin-2-ylmethyl)benzamide
CID 106627555
3-bromo-4-fluoro-N-methyl-N-(piperidin-2-ylmethyl)benzamide
CID 107956374
N-methyl-2,4-dioxo-N-(piperidin-2-ylmethyl)-1H-pyrimidine-6-carboxamide
CID 106627561
N-methyl-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide
CID 106607527
2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608014
3-fluoro-N-methyl-5-nitro-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607775
3,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylbenzamide
CID 106626473
2,4,6-trifluoro-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607688
2,4,5-trifluoro-3-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607911

Frequently Asked Questions

What is the IUPAC name of 3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide?
The IUPAC name of 3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide (CID 107705334) is 3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide.
What is the SMILES notation for 3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide?
The canonical SMILES for 3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide is CN(CC1CCCCN1)C(=O)c1cc(O)cc(O)c1.
What is the InChIKey of 3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide?
The InChIKey is HYKIATMLOATBON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-16(9-11-4-2-3-5-15-11)14(19)10-6-12(17)8-13(18)7-10/h6-8,11,15,17-18H,2-5,9H2,1H3.
What are the key properties of 3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide?
3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide has a molecular weight of 264.32 g/mol, XLogP of 1.31, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dihydroxy-N-methyl-N-(piperidin-2-ylmethyl)benzamide is sourced from PubChem (CID 107705334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).