N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide

C16H17NO3 — CID 39370043

IUPACN-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)N[C@@H](CO)c1ccccc1
InChIInChI=1S/C16H17NO3/c1-20-15-10-6-5-9-13(15)16(19)17-14(11-18)12-7-3-2-4-8-12/h2-10,14,18H,11H2,1H3,(H,17,19)/t14-/m0/s1
InChIKeyKDGCLHFXFHYWGF-AWEZNQCLSA-N
MW271.32 g/mol
LogP2.16
Rot. Bonds5

About N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide

N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide (PubChem CID 39370043) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide
PubChem CID39370043
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)N[C@@H](CO)c1ccccc1
InChIInChI=1S/C16H17NO3/c1-20-15-10-6-5-9-13(15)16(19)17-14(11-18)12-7-3-2-4-8-12/h2-10,14,18H,11H2,1H3,(H,17,19)/t14-/m0/s1
InChIKeyKDGCLHFXFHYWGF-AWEZNQCLSA-N
XLogP2.16
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-N-[(1S)-2-hydroxy-1-phenylethyl]-3-methoxybenzamide
CID 103945214
N-(2-chloro-1-phenylethyl)-2-methoxybenzamide
CID 114300240
5-chloro-N-(2-hydroxy-1-phenylethyl)-2-methoxybenzamide
CID 63184777
N-(3-hydrazinyl-3-oxo-1-phenylpropyl)-2-methoxybenzamide
CID 3102871
N-(2-hydroxy-1-phenylethyl)-2-(methoxymethyl)benzamide
CID 63182538
2-chloro-N-[(1R)-2-hydroxy-1-phenylethyl]benzamide
CID 39374837
2-fluoro-N-(2-hydroxy-1-phenylethyl)benzamide
CID 3315693
N-(2-amino-1-phenylethyl)-2-hydroxy-3-methoxybenzamide
CID 63753586
N-[(1R)-2-hydroxy-1-phenylethyl]-2-[[6-[[2-[[(1R)-2-hydroxy-1-phenylethyl]carbamoyl]phenoxy]methyl]-2-pyridinyl]methoxy]benzamide
CID 11365555
N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide
CID 103772803
2-hydroxy-N-[(1R)-2-hydroxy-1-phenylethyl]-4-methoxybenzamide
CID 103944607
methyl (3S)-3-(4-chlorophenyl)-3-[(2-methoxybenzoyl)amino]propanoate
CID 40813309

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide?
The IUPAC name of N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide (CID 39370043) is N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide.
What is the SMILES notation for N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide?
The canonical SMILES for N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide is COc1ccccc1C(=O)N[C@@H](CO)c1ccccc1.
What is the InChIKey of N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide?
The InChIKey is KDGCLHFXFHYWGF-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H17NO3/c1-20-15-10-6-5-9-13(15)16(19)17-14(11-18)12-7-3-2-4-8-12/h2-10,14,18H,11H2,1H3,(H,17,19)/t14-/m0/s1.
What are the key properties of N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide?
N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide has a molecular weight of 271.32 g/mol, XLogP of 2.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide is sourced from PubChem (CID 39370043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).