N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide

C16H17NO2 — CID 93090514

IUPACN-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide
SMILESC[C@@H](O)c1ccc(NC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C16H17NO2/c1-12(18)14-7-9-15(10-8-14)17-16(19)11-13-5-3-2-4-6-13/h2-10,12,18H,11H2,1H3,(H,17,19)/t12-/m1/s1
InChIKeyCVZFIXRZTIZTDQ-GFCCVEGCSA-N
MW255.32 g/mol
LogP2.92
Rot. Bonds4

About N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide

N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide (PubChem CID 93090514) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide
PubChem CID93090514
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC NameN-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide
SMILESC[C@@H](O)c1ccc(NC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C16H17NO2/c1-12(18)14-7-9-15(10-8-14)17-16(19)11-13-5-3-2-4-6-13/h2-10,12,18H,11H2,1H3,(H,17,19)/t12-/m1/s1
InChIKeyCVZFIXRZTIZTDQ-GFCCVEGCSA-N
XLogP2.92
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide?
The IUPAC name of N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide (CID 93090514) is N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide.
What is the SMILES notation for N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide?
The canonical SMILES for N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide is C[C@@H](O)c1ccc(NC(=O)Cc2ccccc2)cc1.
What is the InChIKey of N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide?
The InChIKey is CVZFIXRZTIZTDQ-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H17NO2/c1-12(18)14-7-9-15(10-8-14)17-16(19)11-13-5-3-2-4-6-13/h2-10,12,18H,11H2,1H3,(H,17,19)/t12-/m1/s1.
What are the key properties of N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide?
N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide has a molecular weight of 255.32 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide is sourced from PubChem (CID 93090514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).