5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride

C17H20Cl2N4O2 — CID 119494570

IUPAC5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride
SMILESCOc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCNCC2)cn1.Cl
InChIInChI=1S/C17H19ClN4O2.ClH/c1-24-15-4-2-12(18)10-14(15)17(23)21-16-5-3-13(11-20-16)22-8-6-19-7-9-22;/h2-5,10-11,19H,6-9H2,1H3,(H,20,21,23);1H
InChIKeyZRWKEXZUHSEHCR-UHFFFAOYSA-N
MW383.28 g/mol
LogP2.83
Rot. Bonds4

About 5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride

5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride (PubChem CID 119494570) has the molecular formula C17H20Cl2N4O2 and a molecular weight of 383.28 g/mol. Its IUPAC name is 5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride.

Molecular Properties

Compound Name5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride
PubChem CID119494570
Molecular FormulaC17H20Cl2N4O2
Molecular Weight383.28 g/mol
Exact Mass382.10
IUPAC Name5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride
SMILESCOc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCNCC2)cn1.Cl
InChIInChI=1S/C17H19ClN4O2.ClH/c1-24-15-4-2-12(18)10-14(15)17(23)21-16-5-3-13(11-20-16)22-8-6-19-7-9-22;/h2-5,10-11,19H,6-9H2,1H3,(H,20,21,23);1H
InChIKeyZRWKEXZUHSEHCR-UHFFFAOYSA-N
XLogP2.83
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.28
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride
CID 119494622
2-(4-chlorophenoxy)-N-(5-piperazin-1-yl-2-pyridinyl)acetamide;hydrochloride
CID 119494378
3-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide
CID 119494679
3,4-dichloro-N-(5-piperazin-1-yl-2-pyridinyl)benzamide
CID 119494091
6-[(5-chloro-2-methoxybenzoyl)amino]pyridine-3-carbonyl chloride
CID 174302752
5-bromo-2-methyl-N-(5-piperazin-1-yl-2-pyridinyl)benzamide
CID 119494211
N-(5-piperazin-1-yl-2-pyridinyl)-4-propan-2-ylbenzamide;hydrochloride
CID 119494632
5-chloro-N-(5-chloro-2-pyridinyl)-2-[[4-(1,4-diazepan-1-yl)benzoyl]amino]benzamide
CID 21075332
2-methylsulfanyl-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride
CID 119494252
6-methyl-N-(5-piperazin-1-yl-2-pyridinyl)pyridine-3-carboxamide;dihydrochloride
CID 119494408
6-chloro-4-methyl-N-(5-piperazin-1-yl-2-pyridinyl)-1H-indole-2-carboxamide
CID 167808805
2-oxo-N-(5-piperazin-1-yl-2-pyridinyl)-1H-pyridine-4-carboxamide;hydrochloride
CID 119494214

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride?
The IUPAC name of 5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride (CID 119494570) is 5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride.
What is the SMILES notation for 5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride?
The canonical SMILES for 5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride is COc1ccc(Cl)cc1C(=O)Nc1ccc(N2CCNCC2)cn1.Cl.
What is the InChIKey of 5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride?
The InChIKey is ZRWKEXZUHSEHCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN4O2.ClH/c1-24-15-4-2-12(18)10-14(15)17(23)21-16-5-3-13(11-20-16)22-8-6-19-7-9-22;/h2-5,10-11,19H,6-9H2,1H3,(H,20,21,23);1H.
What are the key properties of 5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride?
5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride has a molecular weight of 383.28 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methoxy-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride is sourced from PubChem (CID 119494570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).