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

C14H19ClN2O — CID 82883859

IUPAC5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCc1ccc(Cl)cc1C(=O)NCC1CCCNC1
InChIInChI=1S/C14H19ClN2O/c1-10-4-5-12(15)7-13(10)14(18)17-9-11-3-2-6-16-8-11/h4-5,7,11,16H,2-3,6,8-9H2,1H3,(H,17,18)
InChIKeyLDEJLVUCNGGNRN-UHFFFAOYSA-N
MW266.77 g/mol
LogP2.38
Rot. Bonds3

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

5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide (PubChem CID 82883859) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide
PubChem CID82883859
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCc1ccc(Cl)cc1C(=O)NCC1CCCNC1
InChIInChI=1S/C14H19ClN2O/c1-10-4-5-12(15)7-13(10)14(18)17-9-11-3-2-6-16-8-11/h4-5,7,11,16H,2-3,6,8-9H2,1H3,(H,17,18)
InChIKeyLDEJLVUCNGGNRN-UHFFFAOYSA-N
XLogP2.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3,4-dimethylphenyl)-2-fluoro-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462137
3-iodo-4-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 119464322
5-chloro-3-methyl-N-(piperidin-3-ylmethyl)-1-benzofuran-2-carboxamide;hydrochloride
CID 119461945
2-iodo-5-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 119461515
2-(2,4-dichlorophenyl)-N-(piperidin-3-ylmethyl)acetamide;hydrochloride
CID 119459765
2-iodo-3-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 113265456
2-chloro-5-methylsulfanyl-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462907
2,4,5-trimethyl-N-(pyrrolidin-3-ylmethyl)benzamide
CID 115271836
2,5-dichloro-N-(piperidin-3-ylmethyl)thiophene-3-carboxamide;hydrochloride
CID 119461858
2-methyl-N-(piperidin-3-ylmethyl)furan-3-carboxamide
CID 60725298
5-fluoro-2-methyl-N-(2-piperidin-3-ylethyl)benzamide
CID 55144401
5-bromo-2-methyl-N-(2-piperidin-3-ylethyl)benzamide
CID 65311677

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide?
The IUPAC name of 5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide (CID 82883859) is 5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide.
What is the SMILES notation for 5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide?
The canonical SMILES for 5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide is Cc1ccc(Cl)cc1C(=O)NCC1CCCNC1.
What is the InChIKey of 5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide?
The InChIKey is LDEJLVUCNGGNRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-10-4-5-12(15)7-13(10)14(18)17-9-11-3-2-6-16-8-11/h4-5,7,11,16H,2-3,6,8-9H2,1H3,(H,17,18).
What are the key properties of 5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide?
5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide has a molecular weight of 266.77 g/mol, XLogP of 2.38, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide is sourced from PubChem (CID 82883859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).