N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide

C19H18ClFN2O — CID 20929929

IUPACN-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)C1=CCN(Cc2ccccc2F)CC1
InChIInChI=1S/C19H18ClFN2O/c20-16-5-7-17(8-6-16)22-19(24)14-9-11-23(12-10-14)13-15-3-1-2-4-18(15)21/h1-9H,10-13H2,(H,22,24)
InChIKeyOIVFNCRUWQKOQF-UHFFFAOYSA-N
MW344.82 g/mol
LogP4.25
Rot. Bonds4

About N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide

N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide (PubChem CID 20929929) has the molecular formula C19H18ClFN2O and a molecular weight of 344.82 g/mol. Its IUPAC name is N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide
PubChem CID20929929
Molecular FormulaC19H18ClFN2O
Molecular Weight344.82 g/mol
Exact Mass344.11
IUPAC NameN-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)C1=CCN(Cc2ccccc2F)CC1
InChIInChI=1S/C19H18ClFN2O/c20-16-5-7-17(8-6-16)22-19(24)14-9-11-23(12-10-14)13-15-3-1-2-4-18(15)21/h1-9H,10-13H2,(H,22,24)
InChIKeyOIVFNCRUWQKOQF-UHFFFAOYSA-N
XLogP4.25
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.82
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2-fluorophenyl)methyl]-N-phenyl-3,6-dihydro-2H-pyridine-4-carboxamide
CID 20929932
N-[(2-fluorophenyl)methyl]-1-[(3-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide
CID 53051250
1-[(4-chlorophenyl)methyl]-N-(3,5-dimethoxyphenyl)-3,6-dihydro-2H-pyridine-4-carboxamide
CID 20929946
2,5-dichloro-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]benzamide
CID 3971845
N-(4-chlorophenyl)-4-[2-(2-fluorophenyl)ethyl]piperazine-1-carboxamide
CID 110412057
1-[(4-fluorophenyl)methyl]-N-(3-methoxyphenyl)-3,6-dihydro-2H-pyridine-4-carboxamide
CID 20929937
2-(4-chlorophenyl)-1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]ethanone
CID 113074065
1-(4-chlorophenyl)sulfonyl-4-[(2-fluorophenyl)methyl]piperazine;oxalic acid
CID 17366247
4-[(2-fluorophenyl)methyl]-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide
CID 35766423
N-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine-1-carboxamide
CID 19293497
4-chloro-N-[3-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-3-oxopropyl]benzamide
CID 25471182
N-(4-chlorophenyl)-6-[(2-fluorophenyl)methylamino]-2-methylpyrimidine-4-carboxamide
CID 109369606

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide (CID 20929929) is N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide is O=C(Nc1ccc(Cl)cc1)C1=CCN(Cc2ccccc2F)CC1.
What is the InChIKey of N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide?
The InChIKey is OIVFNCRUWQKOQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClFN2O/c20-16-5-7-17(8-6-16)22-19(24)14-9-11-23(12-10-14)13-15-3-1-2-4-18(15)21/h1-9H,10-13H2,(H,22,24).
What are the key properties of N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide?
N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide has a molecular weight of 344.82 g/mol, XLogP of 4.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-1-[(2-fluorophenyl)methyl]-3,6-dihydro-2H-pyridine-4-carboxamide is sourced from PubChem (CID 20929929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).