4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide

C17H18Cl2N4O — CID 159848702

IUPAC4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)nc1
InChIInChI=1S/C17H18Cl2N4O/c1-12-2-5-16(20-11-12)21-17(24)23-8-6-22(7-9-23)15-4-3-13(18)10-14(15)19/h2-5,10-11H,6-9H2,1H3,(H,20,21,24)
InChIKeyHTVLZMGSOOZMAK-UHFFFAOYSA-N
MW365.26 g/mol
LogP4.05
Rot. Bonds2

About 4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide

4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide (PubChem CID 159848702) has the molecular formula C17H18Cl2N4O and a molecular weight of 365.26 g/mol. Its IUPAC name is 4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide
PubChem CID159848702
Molecular FormulaC17H18Cl2N4O
Molecular Weight365.26 g/mol
Exact Mass364.09
IUPAC Name4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)nc1
InChIInChI=1S/C17H18Cl2N4O/c1-12-2-5-16(20-11-12)21-17(24)23-8-6-22(7-9-23)15-4-3-13(18)10-14(15)19/h2-5,10-11H,6-9H2,1H3,(H,20,21,24)
InChIKeyHTVLZMGSOOZMAK-UHFFFAOYSA-N
XLogP4.05
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.26
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide;4-(2,4-difluorophenyl)-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3,4-difluorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide;4-(3,5-difluorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide;4-(5-fluoro-2-pyridinyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide;4-(4-isocyanophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide
CID 159848698
N-[5-(2,4-dichlorophenyl)-2-pyridinyl]-5-methyl-8-(4-methylpiperazin-1-yl)-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 162675242
4-(3-chloro-2-pyridinyl)-4-fluoro-N-(5-methyl-2-pyridinyl)piperidine-1-carboxamide;methane
CID 161177971
N-(5-methyl-2-pyridinyl)-4-[6-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide
CID 158285973
4-(2-chlorophenyl)-N-(2,4-dichlorophenyl)piperazine-1-carboxamide
CID 113112852
4-(4-chlorophenyl)-N-(5-hydroxy-2-pyridinyl)-1,4-diazepane-1-carboxamide
CID 142622847
2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-N-(5-chloro-2-pyridinyl)acetamide
CID 6467861
4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide
CID 26028133
[4-(2,4-dichlorophenyl)piperazin-1-yl]-(3-methylphenyl)methanone
CID 113080198
(2,5-dichlorophenyl)-[4-(2,4-dimethylphenyl)piperazin-1-yl]methanone
CID 71822663
N-[5-(4-chloro-2-methylphenyl)-2-pyridinyl]-5-fluoro-8-(4-methylpiperazin-1-yl)-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 162659713
4-(2,4-dichlorophenyl)-N-(pyridin-4-ylmethyl)piperazine-1-carboxamide
CID 113108791

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide?
The IUPAC name of 4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide (CID 159848702) is 4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide is Cc1ccc(NC(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)nc1.
What is the InChIKey of 4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide?
The InChIKey is HTVLZMGSOOZMAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N4O/c1-12-2-5-16(20-11-12)21-17(24)23-8-6-22(7-9-23)15-4-3-13(18)10-14(15)19/h2-5,10-11H,6-9H2,1H3,(H,20,21,24).
What are the key properties of 4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide?
4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide has a molecular weight of 365.26 g/mol, XLogP of 4.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)piperazine-1-carboxamide is sourced from PubChem (CID 159848702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).