6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide

C22H19N5O — CID 109334786

IUPAC6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)Nc2cccc3cccnc23)nc(Nc2ccccc2C)n1
InChIInChI=1S/C22H19N5O/c1-14-7-3-4-10-17(14)26-22-24-15(2)13-19(27-22)21(28)25-18-11-5-8-16-9-6-12-23-20(16)18/h3-13H,1-2H3,(H,25,28)(H,24,26,27)
InChIKeyRVNMJJRFAPVMCN-UHFFFAOYSA-N
MW369.43 g/mol
LogP4.64
Rot. Bonds4

About 6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide

6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide (PubChem CID 109334786) has the molecular formula C22H19N5O and a molecular weight of 369.43 g/mol. Its IUPAC name is 6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide
PubChem CID109334786
Molecular FormulaC22H19N5O
Molecular Weight369.43 g/mol
Exact Mass369.16
IUPAC Name6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)Nc2cccc3cccnc23)nc(Nc2ccccc2C)n1
InChIInChI=1S/C22H19N5O/c1-14-7-3-4-10-17(14)26-22-24-15(2)13-19(27-22)21(28)25-18-11-5-8-16-9-6-12-23-20(16)18/h3-13H,1-2H3,(H,25,28)(H,24,26,27)
InChIKeyRVNMJJRFAPVMCN-UHFFFAOYSA-N
XLogP4.64
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-2-[(2-methylphenyl)methylamino]-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109327440
6-methyl-2-(propan-2-ylamino)-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109319423
2-(4-cyanoanilino)-6-methyl-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109338079
6-methyl-N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyrimidine-4-carboxamide
CID 109330522
2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide
CID 109176218
N-(4-methoxyphenyl)-6-methyl-2-(2-methylanilino)pyrimidine-4-carboxamide
CID 109334759
2-hydrazinyl-6-methyl-N-(2-methylphenyl)pyrimidine-4-carboxamide
CID 114220571
6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide
CID 109100392
N-(4-ethylphenyl)-6-methyl-2-(2-methylanilino)pyrimidine-4-carboxamide
CID 109334736
6-methyl-N-(2-methylphenyl)-2-(2-propan-2-yloxyanilino)pyrimidine-4-carboxamide
CID 109334845
N-(5-chloro-2-methoxyphenyl)-6-methyl-2-(2-methylanilino)pyrimidine-4-carboxamide
CID 109334755
N-ethyl-6-methyl-N-phenyl-2-(quinolin-8-ylamino)pyrimidine-4-carboxamide
CID 109336437

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide?
The IUPAC name of 6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide (CID 109334786) is 6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide.
What is the SMILES notation for 6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide?
The canonical SMILES for 6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide is Cc1cc(C(=O)Nc2cccc3cccnc23)nc(Nc2ccccc2C)n1.
What is the InChIKey of 6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide?
The InChIKey is RVNMJJRFAPVMCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O/c1-14-7-3-4-10-17(14)26-22-24-15(2)13-19(27-22)21(28)25-18-11-5-8-16-9-6-12-23-20(16)18/h3-13H,1-2H3,(H,25,28)(H,24,26,27).
What are the key properties of 6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide?
6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide has a molecular weight of 369.43 g/mol, XLogP of 4.64, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide is sourced from PubChem (CID 109334786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).