N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide

C24H19FN4O2 — CID 53143644

IUPACN-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
SMILESCOc1ccc(-c2ncc(C(=O)Nc3ccc(F)cc3C)c(-c3ccncc3)n2)cc1
InChIInChI=1S/C24H19FN4O2/c1-15-13-18(25)5-8-21(15)28-24(30)20-14-27-23(17-3-6-19(31-2)7-4-17)29-22(20)16-9-11-26-12-10-16/h3-14H,1-2H3,(H,28,30)
InChIKeyQIGIYNVKSVTKDO-UHFFFAOYSA-N
MW414.44 g/mol
LogP4.91
Rot. Bonds5

About N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide

N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide (PubChem CID 53143644) has the molecular formula C24H19FN4O2 and a molecular weight of 414.44 g/mol. Its IUPAC name is N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
PubChem CID53143644
Molecular FormulaC24H19FN4O2
Molecular Weight414.44 g/mol
Exact Mass414.15
IUPAC NameN-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
SMILESCOc1ccc(-c2ncc(C(=O)Nc3ccc(F)cc3C)c(-c3ccncc3)n2)cc1
InChIInChI=1S/C24H19FN4O2/c1-15-13-18(25)5-8-21(15)28-24(30)20-14-27-23(17-3-6-19(31-2)7-4-17)29-22(20)16-9-11-26-12-10-16/h3-14H,1-2H3,(H,28,30)
InChIKeyQIGIYNVKSVTKDO-UHFFFAOYSA-N
XLogP4.91
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.44
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143659
N,2-bis(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143638
N-(3-methoxyphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143637
N-(2-fluoro-5-methylphenyl)-2-phenyl-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143528
2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143621
N-(4-fluoro-2-methylphenyl)-3-methoxynaphthalene-2-carboxamide
CID 7924533
N-(cyclopropylmethyl)-2-(4-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143618
2-fluoro-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide
CID 114037696
[2-[(4-methoxybenzoyl)amino]-4-pyridin-4-ylphenyl]carbamic acid
CID 69100917
N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)acetamide
CID 2676308
1-N,2-N-bis(4-fluoro-2-methylphenyl)benzene-1,2-dicarboxamide
CID 2811694
6-fluoro-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide
CID 63978415

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide?
The IUPAC name of N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide (CID 53143644) is N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide.
What is the SMILES notation for N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide?
The canonical SMILES for N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide is COc1ccc(-c2ncc(C(=O)Nc3ccc(F)cc3C)c(-c3ccncc3)n2)cc1.
What is the InChIKey of N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide?
The InChIKey is QIGIYNVKSVTKDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19FN4O2/c1-15-13-18(25)5-8-21(15)28-24(30)20-14-27-23(17-3-6-19(31-2)7-4-17)29-22(20)16-9-11-26-12-10-16/h3-14H,1-2H3,(H,28,30).
What are the key properties of N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide?
N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide has a molecular weight of 414.44 g/mol, XLogP of 4.91, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide is sourced from PubChem (CID 53143644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).