6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide

C19H23ClN4O2 — CID 109096369

IUPAC6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide
SMILESCc1cc(C)c(NC(=O)c2cccc(C(=O)NCCN(C)C)n2)c(Cl)c1
InChIInChI=1S/C19H23ClN4O2/c1-12-10-13(2)17(14(20)11-12)23-19(26)16-7-5-6-15(22-16)18(25)21-8-9-24(3)4/h5-7,10-11H,8-9H2,1-4H3,(H,21,25)(H,23,26)
InChIKeyMFAKHCXPEGKDHM-UHFFFAOYSA-N
MW374.87 g/mol
LogP2.90
Rot. Bonds6

About 6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide

6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide (PubChem CID 109096369) has the molecular formula C19H23ClN4O2 and a molecular weight of 374.87 g/mol. Its IUPAC name is 6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide
PubChem CID109096369
Molecular FormulaC19H23ClN4O2
Molecular Weight374.87 g/mol
Exact Mass374.15
IUPAC Name6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide
SMILESCc1cc(C)c(NC(=O)c2cccc(C(=O)NCCN(C)C)n2)c(Cl)c1
InChIInChI=1S/C19H23ClN4O2/c1-12-10-13(2)17(14(20)11-12)23-19(26)16-7-5-6-15(22-16)18(25)21-8-9-24(3)4/h5-7,10-11H,8-9H2,1-4H3,(H,21,25)(H,23,26)
InChIKeyMFAKHCXPEGKDHM-UHFFFAOYSA-N
XLogP2.90
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.87
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-[3-(dimethylamino)propyl]-6-N-(2,4,6-trimethylphenyl)pyridine-2,6-dicarboxamide
CID 109096578
3-N-(2-chloro-4,6-dimethylphenyl)-1-N-[3-(dimethylamino)propyl]benzene-1,3-dicarboxamide
CID 109053445
6-N-(5-chloro-2-methylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide
CID 109096365
6-N-(3,5-dichlorophenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide
CID 109096412
6-N-(2-chloro-4,6-dimethylphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099984
6-N-(2,5-dichlorophenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide
CID 109096411
N-(2-chloro-4,6-dimethylphenyl)-2-[3-(dimethylamino)propylamino]-6-methylpyrimidine-4-carboxamide
CID 109325499
N-(2-chloro-4,6-dimethylphenyl)-6-[3-(dimethylamino)propylamino]-2-methylpyrimidine-4-carboxamide
CID 109366648
6-N,6-N-diethyl-2-N-(2,4,6-trimethylphenyl)pyridine-2,6-dicarboxamide
CID 109098988
N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide
CID 19224279
2-N-[2-(dimethylamino)ethyl]-6-N-[4-(dimethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 109096394
2-N-[2-(dimethylamino)ethyl]-6-N-(4-ethylphenyl)pyridine-2,6-dicarboxamide
CID 109096349

Frequently Asked Questions

What is the IUPAC name of 6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide (CID 109096369) is 6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide is Cc1cc(C)c(NC(=O)c2cccc(C(=O)NCCN(C)C)n2)c(Cl)c1.
What is the InChIKey of 6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide?
The InChIKey is MFAKHCXPEGKDHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN4O2/c1-12-10-13(2)17(14(20)11-12)23-19(26)16-7-5-6-15(22-16)18(25)21-8-9-24(3)4/h5-7,10-11H,8-9H2,1-4H3,(H,21,25)(H,23,26).
What are the key properties of 6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide?
6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide has a molecular weight of 374.87 g/mol, XLogP of 2.90, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2-chloro-4,6-dimethylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109096369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).