2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide

C14H20ClN3O — CID 63659172

IUPAC2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide
SMILESNc1cccc(Cl)c1C(=O)NCCN1CCCCC1
InChIInChI=1S/C14H20ClN3O/c15-11-5-4-6-12(16)13(11)14(19)17-7-10-18-8-2-1-3-9-18/h4-6H,1-3,7-10,16H2,(H,17,19)
InChIKeyHZLSVWCVSDFEIB-UHFFFAOYSA-N
MW281.79 g/mol
LogP2.14
Rot. Bonds4

About 2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide

2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide (PubChem CID 63659172) has the molecular formula C14H20ClN3O and a molecular weight of 281.79 g/mol. Its IUPAC name is 2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide.

Molecular Properties

Compound Name2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide
PubChem CID63659172
Molecular FormulaC14H20ClN3O
Molecular Weight281.79 g/mol
Exact Mass281.13
IUPAC Name2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide
SMILESNc1cccc(Cl)c1C(=O)NCCN1CCCCC1
InChIInChI=1S/C14H20ClN3O/c15-11-5-4-6-12(16)13(11)14(19)17-7-10-18-8-2-1-3-9-18/h4-6H,1-3,7-10,16H2,(H,17,19)
InChIKeyHZLSVWCVSDFEIB-UHFFFAOYSA-N
XLogP2.14
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.79
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-amino-2-chloro-N-(2-piperidin-1-ylethyl)benzamide
CID 112575773
2,3-dichloro-N-(2-piperidin-1-ylethyl)benzamide
CID 17173706
2-amino-6-chloro-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzamide
CID 70334221
2,6-dichloro-N-(2-piperazin-1-ylethyl)benzamide
CID 43422024
2-chloro-N-(2-pyrrolidin-1-ylethyl)benzamide;hydrochloride
CID 2941366
2-amino-6-chloro-N-(2-piperidin-1-ylpropyl)benzamide
CID 63659855
2-(2-aminophenyl)-N-[2-(azepan-1-yl)ethyl]acetamide
CID 61239604
3-chloro-N-(2-piperidin-1-ylethyl)benzamide
CID 4581034
5-amino-2-chloro-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 62636573
2-amino-6-chloro-N-[2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]benzamide
CID 53470001
6-chloro-N-(2-piperidin-1-ylethyl)pyridine-2-carboxamide
CID 55052305
2-amino-6-chloro-N-(1-ethylpiperidin-3-yl)benzamide
CID 55244136

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide?
The IUPAC name of 2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide (CID 63659172) is 2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide.
What is the SMILES notation for 2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide?
The canonical SMILES for 2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide is Nc1cccc(Cl)c1C(=O)NCCN1CCCCC1.
What is the InChIKey of 2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide?
The InChIKey is HZLSVWCVSDFEIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3O/c15-11-5-4-6-12(16)13(11)14(19)17-7-10-18-8-2-1-3-9-18/h4-6H,1-3,7-10,16H2,(H,17,19).
What are the key properties of 2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide?
2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide has a molecular weight of 281.79 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-chloro-N-(2-piperidin-1-ylethyl)benzamide is sourced from PubChem (CID 63659172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).