2-chloro-N-(1-piperidin-3-ylethyl)benzamide

C14H19ClN2O — CID 62034679

IUPAC2-chloro-N-(1-piperidin-3-ylethyl)benzamide
SMILESCC(NC(=O)c1ccccc1Cl)C1CCCNC1
InChIInChI=1S/C14H19ClN2O/c1-10(11-5-4-8-16-9-11)17-14(18)12-6-2-3-7-13(12)15/h2-3,6-7,10-11,16H,4-5,8-9H2,1H3,(H,17,18)
InChIKeySEQBSQVIWXNLBL-UHFFFAOYSA-N
MW266.77 g/mol
LogP2.46
Rot. Bonds3

About 2-chloro-N-(1-piperidin-3-ylethyl)benzamide

2-chloro-N-(1-piperidin-3-ylethyl)benzamide (PubChem CID 62034679) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 2-chloro-N-(1-piperidin-3-ylethyl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(1-piperidin-3-ylethyl)benzamide
PubChem CID62034679
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name2-chloro-N-(1-piperidin-3-ylethyl)benzamide
SMILESCC(NC(=O)c1ccccc1Cl)C1CCCNC1
InChIInChI=1S/C14H19ClN2O/c1-10(11-5-4-8-16-9-11)17-14(18)12-6-2-3-7-13(12)15/h2-3,6-7,10-11,16H,4-5,8-9H2,1H3,(H,17,18)
InChIKeySEQBSQVIWXNLBL-UHFFFAOYSA-N
XLogP2.46
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 ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dichloro-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119473892
N-(1-piperidin-3-ylethyl)naphthalene-1-carboxamide
CID 43523096
N-(1-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide;hydrochloride
CID 119473992
2,3-difluoro-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119474254
2-hydroxy-3-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 43523069
2-iodo-3-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 103806068
5-chloro-2-iodo-N-(1-piperidin-3-ylethyl)benzamide
CID 103806067
3-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 43523133
5-fluoro-2-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 55144400
4-fluoro-2-hydroxy-N-(1-piperidin-3-ylethyl)benzamide
CID 107014713
N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide
CID 62032705
4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride
CID 119473981

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1-piperidin-3-ylethyl)benzamide?
The IUPAC name of 2-chloro-N-(1-piperidin-3-ylethyl)benzamide (CID 62034679) is 2-chloro-N-(1-piperidin-3-ylethyl)benzamide.
What is the SMILES notation for 2-chloro-N-(1-piperidin-3-ylethyl)benzamide?
The canonical SMILES for 2-chloro-N-(1-piperidin-3-ylethyl)benzamide is CC(NC(=O)c1ccccc1Cl)C1CCCNC1.
What is the InChIKey of 2-chloro-N-(1-piperidin-3-ylethyl)benzamide?
The InChIKey is SEQBSQVIWXNLBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-10(11-5-4-8-16-9-11)17-14(18)12-6-2-3-7-13(12)15/h2-3,6-7,10-11,16H,4-5,8-9H2,1H3,(H,17,18).
What are the key properties of 2-chloro-N-(1-piperidin-3-ylethyl)benzamide?
2-chloro-N-(1-piperidin-3-ylethyl)benzamide has a molecular weight of 266.77 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1-piperidin-3-ylethyl)benzamide is sourced from PubChem (CID 62034679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).