2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide

C14H19ClN2O2 — CID 106627741

IUPAC2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCN(CC1CCCNC1)C(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C14H19ClN2O2/c1-17(9-10-3-2-6-16-8-10)14(19)12-7-11(18)4-5-13(12)15/h4-5,7,10,16,18H,2-3,6,8-9H2,1H3
InChIKeyGWIHGZLMXIQCSE-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.12
Rot. Bonds3

About 2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide

2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide (PubChem CID 106627741) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide
PubChem CID106627741
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCN(CC1CCCNC1)C(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C14H19ClN2O2/c1-17(9-10-3-2-6-16-8-10)14(19)12-7-11(18)4-5-13(12)15/h4-5,7,10,16,18H,2-3,6,8-9H2,1H3
InChIKeyGWIHGZLMXIQCSE-UHFFFAOYSA-N
XLogP2.12
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-3-fluoro-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 107990969
4-bromo-3-chloro-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627732
2,4-dibromo-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 107940298
2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627649
2-fluoro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106628063
5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627610
3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627859
2-fluoro-N,3-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627734
2-bromo-N,3-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 107983274
5-bromo-2-chloro-N-cyclopropyl-N-(piperidin-3-ylmethyl)benzamide
CID 106628689
N-methyl-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride
CID 71642081
2-bromo-3-fluoro-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627953

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide?
The IUPAC name of 2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide (CID 106627741) is 2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide.
What is the SMILES notation for 2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide?
The canonical SMILES for 2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide is CN(CC1CCCNC1)C(=O)c1cc(O)ccc1Cl.
What is the InChIKey of 2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide?
The InChIKey is GWIHGZLMXIQCSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-17(9-10-3-2-6-16-8-10)14(19)12-7-11(18)4-5-13(12)15/h4-5,7,10,16,18H,2-3,6,8-9H2,1H3.
What are the key properties of 2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide?
2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide has a molecular weight of 282.77 g/mol, XLogP of 2.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide is sourced from PubChem (CID 106627741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).