N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide

C22H22FN3O — CID 109170542

IUPACN-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide
SMILESCCN(C(=O)c1ccnc(NCc2ccccc2F)c1)c1cccc(C)c1
InChIInChI=1S/C22H22FN3O/c1-3-26(19-9-6-7-16(2)13-19)22(27)17-11-12-24-21(14-17)25-15-18-8-4-5-10-20(18)23/h4-14H,3,15H2,1-2H3,(H,24,25)
InChIKeyRZMLXNHGPISYLB-UHFFFAOYSA-N
MW363.44 g/mol
LogP4.81
Rot. Bonds6

About N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide

N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide (PubChem CID 109170542) has the molecular formula C22H22FN3O and a molecular weight of 363.44 g/mol. Its IUPAC name is N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide
PubChem CID109170542
Molecular FormulaC22H22FN3O
Molecular Weight363.44 g/mol
Exact Mass363.17
IUPAC NameN-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide
SMILESCCN(C(=O)c1ccnc(NCc2ccccc2F)c1)c1cccc(C)c1
InChIInChI=1S/C22H22FN3O/c1-3-26(19-9-6-7-16(2)13-19)22(27)17-11-12-24-21(14-17)25-15-18-8-4-5-10-20(18)23/h4-14H,3,15H2,1-2H3,(H,24,25)
InChIKeyRZMLXNHGPISYLB-UHFFFAOYSA-N
XLogP4.81
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.44
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-[2-(4-fluorophenyl)ethylamino]-N-(3-methylphenyl)pyridine-4-carboxamide
CID 109172719
2-[(2-chlorophenyl)methylamino]-N-ethyl-N-phenylpyridine-4-carboxamide
CID 109170820
2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide
CID 109178566
N-butyl-2-[(2-fluorophenyl)methylamino]pyridine-4-carboxamide
CID 109165416
methyl 4-[[4-[ethyl-(3-methylphenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109178670
2-[(2-fluorophenyl)methylamino]-N-pentylpyridine-4-carboxamide
CID 109170487
N-[2-(dimethylamino)ethyl]-2-[(2-fluorophenyl)methylamino]pyridine-4-carboxamide
CID 109167657
N-ethyl-N-(3-methylphenyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide
CID 109178870
N-benzyl-2-[(2-fluorophenyl)methylamino]-N-propan-2-ylpyridine-4-carboxamide
CID 109170485
3-N-ethyl-1-N-(2-fluorophenyl)-3-N-(3-methylphenyl)benzene-1,3-dicarboxamide
CID 109057447
4-N-ethyl-2-N-[2-(2-fluorophenyl)ethyl]-4-N-phenylpyridine-2,4-dicarboxamide
CID 109088003
2-[(2-fluorophenyl)methylamino]-N-(3-methoxypropyl)pyridine-4-carboxamide
CID 109166991

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide?
The IUPAC name of N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide (CID 109170542) is N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide?
The canonical SMILES for N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide is CCN(C(=O)c1ccnc(NCc2ccccc2F)c1)c1cccc(C)c1.
What is the InChIKey of N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide?
The InChIKey is RZMLXNHGPISYLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22FN3O/c1-3-26(19-9-6-7-16(2)13-19)22(27)17-11-12-24-21(14-17)25-15-18-8-4-5-10-20(18)23/h4-14H,3,15H2,1-2H3,(H,24,25).
What are the key properties of N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide?
N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide has a molecular weight of 363.44 g/mol, XLogP of 4.81, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109170542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).