2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide

C20H24ClN3O2 — CID 109090481

IUPAC2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
SMILESCCCN(CCC)C(=O)c1ccnc(C(=O)Nc2cccc(Cl)c2C)c1
InChIInChI=1S/C20H24ClN3O2/c1-4-11-24(12-5-2)20(26)15-9-10-22-18(13-15)19(25)23-17-8-6-7-16(21)14(17)3/h6-10,13H,4-5,11-12H2,1-3H3,(H,23,25)
InChIKeyXIEDCNUPSKRNPF-UHFFFAOYSA-N
MW373.88 g/mol
LogP4.56
Rot. Bonds7

About 2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide

2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide (PubChem CID 109090481) has the molecular formula C20H24ClN3O2 and a molecular weight of 373.88 g/mol. Its IUPAC name is 2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
PubChem CID109090481
Molecular FormulaC20H24ClN3O2
Molecular Weight373.88 g/mol
Exact Mass373.16
IUPAC Name2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
SMILESCCCN(CCC)C(=O)c1ccnc(C(=O)Nc2cccc(Cl)c2C)c1
InChIInChI=1S/C20H24ClN3O2/c1-4-11-24(12-5-2)20(26)15-9-10-22-18(13-15)19(25)23-17-8-6-7-16(21)14(17)3/h6-10,13H,4-5,11-12H2,1-3H3,(H,23,25)
InChIKeyXIEDCNUPSKRNPF-UHFFFAOYSA-N
XLogP4.56
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.88
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-(2-chlorophenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109090478
2-N-(3-chloro-2-methylphenyl)-4-N-ethyl-4-N-phenylpyridine-2,4-dicarboxamide
CID 109092335
2-N-(3-acetamidophenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109090505
4-N-tert-butyl-2-N-(3-chloro-2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109089161
N-(3-chloro-2-methylphenyl)-4-(4-ethylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109084484
2-N,2-N,4-N,4-N-tetrapropylpyridine-2,4-dicarboxamide
CID 109090449
2-N-[4-(diethylamino)phenyl]-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109090511
2-N-[(4-chlorophenyl)methyl]-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109086759
4-N-(3-chloro-2-methylphenyl)-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
CID 109092904
4-N-(2-chlorophenyl)-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092151
4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide
CID 109077995
2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide
CID 109098998

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide (CID 109090481) is 2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide is CCCN(CCC)C(=O)c1ccnc(C(=O)Nc2cccc(Cl)c2C)c1.
What is the InChIKey of 2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide?
The InChIKey is XIEDCNUPSKRNPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClN3O2/c1-4-11-24(12-5-2)20(26)15-9-10-22-18(13-15)19(25)23-17-8-6-7-16(21)14(17)3/h6-10,13H,4-5,11-12H2,1-3H3,(H,23,25).
What are the key properties of 2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide?
2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide has a molecular weight of 373.88 g/mol, XLogP of 4.56, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109090481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).