5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide

C16H23ClN2O — CID 82883488

IUPAC5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide
SMILESCCN(CC1CCNCC1)C(=O)c1cc(Cl)ccc1C
InChIInChI=1S/C16H23ClN2O/c1-3-19(11-13-6-8-18-9-7-13)16(20)15-10-14(17)5-4-12(15)2/h4-5,10,13,18H,3,6-9,11H2,1-2H3
InChIKeyAXQYCKTVQJHFSM-UHFFFAOYSA-N
MW294.83 g/mol
LogP3.11
Rot. Bonds4

About 5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide

5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide (PubChem CID 82883488) has the molecular formula C16H23ClN2O and a molecular weight of 294.83 g/mol. Its IUPAC name is 5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide
PubChem CID82883488
Molecular FormulaC16H23ClN2O
Molecular Weight294.83 g/mol
Exact Mass294.15
IUPAC Name5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide
SMILESCCN(CC1CCNCC1)C(=O)c1cc(Cl)ccc1C
InChIInChI=1S/C16H23ClN2O/c1-3-19(11-13-6-8-18-9-7-13)16(20)15-10-14(17)5-4-12(15)2/h4-5,10,13,18H,3,6-9,11H2,1-2H3
InChIKeyAXQYCKTVQJHFSM-UHFFFAOYSA-N
XLogP3.11
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.83
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-2-hydroxy-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79702379
2,4-dichloro-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79700911
N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)furan-3-carboxamide
CID 79720319
3-chloro-N-ethyl-4-iodo-N-(piperidin-4-ylmethyl)benzamide
CID 103209649
3-(4-chlorophenyl)-N-ethyl-N-(piperidin-4-ylmethyl)prop-2-enamide
CID 79700874
N-ethyl-2,6-dihydroxy-N-(piperidin-4-ylmethyl)benzamide
CID 107690375
5-chloro-2-fluoro-N-(piperidin-4-ylmethyl)-N-propan-2-ylbenzamide
CID 79702408
N-ethyl-5-methyl-N-(piperidin-4-ylmethyl)-1,2-oxazole-3-carboxamide
CID 79720535
N-ethyl-N-(piperidin-4-ylmethyl)furan-2-carboxamide
CID 79720984
N-ethyl-5-iodo-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide
CID 79720840
3-N-ethyl-3-N-(piperidin-4-ylmethyl)benzene-1,3-dicarboxamide
CID 79697262
2-(2-chloro-6-fluorophenyl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide
CID 79698350

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide?
The IUPAC name of 5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide (CID 82883488) is 5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide.
What is the SMILES notation for 5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide?
The canonical SMILES for 5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide is CCN(CC1CCNCC1)C(=O)c1cc(Cl)ccc1C.
What is the InChIKey of 5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide?
The InChIKey is AXQYCKTVQJHFSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23ClN2O/c1-3-19(11-13-6-8-18-9-7-13)16(20)15-10-14(17)5-4-12(15)2/h4-5,10,13,18H,3,6-9,11H2,1-2H3.
What are the key properties of 5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide?
5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide has a molecular weight of 294.83 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)benzamide is sourced from PubChem (CID 82883488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).