N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide

C19H20N2O — CID 23660030

IUPACN-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide
SMILESO=C(NN1CC=C(Cc2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C19H20N2O/c22-19(18-9-5-2-6-10-18)20-21-13-11-17(12-14-21)15-16-7-3-1-4-8-16/h1-11H,12-15H2,(H,20,22)
InChIKeyFMNZIFLTFWQYKL-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.21
Rot. Bonds4

About N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide

N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide (PubChem CID 23660030) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide.

Molecular Properties

Compound NameN-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide
PubChem CID23660030
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC NameN-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide
SMILESO=C(NN1CC=C(Cc2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C19H20N2O/c22-19(18-9-5-2-6-10-18)20-21-13-11-17(12-14-21)15-16-7-3-1-4-8-16/h1-11H,12-15H2,(H,20,22)
InChIKeyFMNZIFLTFWQYKL-UHFFFAOYSA-N
XLogP3.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide?
The IUPAC name of N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide (CID 23660030) is N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide.
What is the SMILES notation for N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide?
The canonical SMILES for N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide is O=C(NN1CC=C(Cc2ccccc2)CC1)c1ccccc1.
What is the InChIKey of N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide?
The InChIKey is FMNZIFLTFWQYKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c22-19(18-9-5-2-6-10-18)20-21-13-11-17(12-14-21)15-16-7-3-1-4-8-16/h1-11H,12-15H2,(H,20,22).
What are the key properties of N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide?
N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide has a molecular weight of 292.38 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)benzamide is sourced from PubChem (CID 23660030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).