2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide

C20H18N2O2 — CID 9468013

IUPAC2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide
SMILESC[C@@H](NC(=O)c1ccccc1Oc1ccccc1)c1cccnc1
InChIInChI=1S/C20H18N2O2/c1-15(16-8-7-13-21-14-16)22-20(23)18-11-5-6-12-19(18)24-17-9-3-2-4-10-17/h2-15H,1H3,(H,22,23)/t15-/m1/s1
InChIKeyWOCJJQHOPPOAIE-OAHLLOKOSA-N
MW318.38 g/mol
LogP4.36
Rot. Bonds5

About 2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide

2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide (PubChem CID 9468013) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is 2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide.

Molecular Properties

Compound Name2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide
PubChem CID9468013
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC Name2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide
SMILESC[C@@H](NC(=O)c1ccccc1Oc1ccccc1)c1cccnc1
InChIInChI=1S/C20H18N2O2/c1-15(16-8-7-13-21-14-16)22-20(23)18-11-5-6-12-19(18)24-17-9-3-2-4-10-17/h2-15H,1H3,(H,22,23)/t15-/m1/s1
InChIKeyWOCJJQHOPPOAIE-OAHLLOKOSA-N
XLogP4.36
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-N-(1-pyridin-3-ylethyl)benzamide
CID 43419974
3-methoxy-N-(1-pyridin-3-ylethyl)naphthalene-2-carboxamide
CID 18110339
N-benzhydryl-2-phenoxybenzamide
CID 3401619
2-phenoxy-N-[1-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]benzamide
CID 118497754
3-hydroxy-N-(1-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 81443089
2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methoxy]-N-[(1S)-1-pyridin-3-ylethyl]benzamide
CID 92903340
N-[(2S)-1-(2-methoxyethoxy)propan-2-yl]-2-pyridin-3-yloxybenzamide
CID 95777270
N-(1-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 51073131
N-[(1R)-1-phenylethyl]-2-propan-2-yloxybenzamide
CID 92666015
4-(phenoxymethyl)-N-[(1R)-1-pyridin-3-ylethyl]benzamide
CID 39952477
methyl N-[(1R)-1-pyridin-3-ylethyl]carbamate
CID 130621848
4-fluoro-N-(1-pyridin-3-ylethyl)benzamide
CID 18162974

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide?
The IUPAC name of 2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide (CID 9468013) is 2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide.
What is the SMILES notation for 2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide?
The canonical SMILES for 2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide is C[C@@H](NC(=O)c1ccccc1Oc1ccccc1)c1cccnc1.
What is the InChIKey of 2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide?
The InChIKey is WOCJJQHOPPOAIE-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-15(16-8-7-13-21-14-16)22-20(23)18-11-5-6-12-19(18)24-17-9-3-2-4-10-17/h2-15H,1H3,(H,22,23)/t15-/m1/s1.
What are the key properties of 2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide?
2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide has a molecular weight of 318.38 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-[(1R)-1-pyridin-3-ylethyl]benzamide is sourced from PubChem (CID 9468013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).