2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide

C23H17FN4O — CID 53143659

IUPAC2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
SMILESCc1ccccc1NC(=O)c1cnc(-c2ccc(F)cc2)nc1-c1ccncc1
InChIInChI=1S/C23H17FN4O/c1-15-4-2-3-5-20(15)27-23(29)19-14-26-22(17-6-8-18(24)9-7-17)28-21(19)16-10-12-25-13-11-16/h2-14H,1H3,(H,27,29)
InChIKeyFFARANQEDZNIRB-UHFFFAOYSA-N
MW384.41 g/mol
LogP4.91
Rot. Bonds4

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

2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide (PubChem CID 53143659) has the molecular formula C23H17FN4O and a molecular weight of 384.41 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
PubChem CID53143659
Molecular FormulaC23H17FN4O
Molecular Weight384.41 g/mol
Exact Mass384.14
IUPAC Name2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
SMILESCc1ccccc1NC(=O)c1cnc(-c2ccc(F)cc2)nc1-c1ccncc1
InChIInChI=1S/C23H17FN4O/c1-15-4-2-3-5-20(15)27-23(29)19-14-26-22(17-6-8-18(24)9-7-17)28-21(19)16-10-12-25-13-11-16/h2-14H,1H3,(H,27,29)
InChIKeyFFARANQEDZNIRB-UHFFFAOYSA-N
XLogP4.91
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.41
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143621
N-(4-fluoro-2-methylphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143644
N-(4-fluoro-3-methylphenyl)-2-(4-fluorophenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143686
N-(2-fluoro-5-methylphenyl)-2-phenyl-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143528
N-(4-methylphenyl)-2-phenyl-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143495
N-[1-(4-fluorophenyl)ethyl]-2-phenyl-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143559
N-(3-methylphenyl)-2-phenyl-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143497
N-(3-methoxyphenyl)-2-(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143637
N,2-bis(4-methoxyphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143638
2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide
CID 53200674
N-(cyclopropylmethyl)-2-(4-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143618
N-(2-methylphenyl)-2-phenylpyrimidine-5-carboxamide
CID 47778991

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide?
The IUPAC name of 2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide (CID 53143659) is 2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide is Cc1ccccc1NC(=O)c1cnc(-c2ccc(F)cc2)nc1-c1ccncc1.
What is the InChIKey of 2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide?
The InChIKey is FFARANQEDZNIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17FN4O/c1-15-4-2-3-5-20(15)27-23(29)19-14-26-22(17-6-8-18(24)9-7-17)28-21(19)16-10-12-25-13-11-16/h2-14H,1H3,(H,27,29).
What are the key properties of 2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide?
2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide has a molecular weight of 384.41 g/mol, XLogP of 4.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide is sourced from PubChem (CID 53143659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).