N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide

C19H23NO2 — CID 126444251

IUPACN-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide
SMILESCC(=O)N[C@H](C)c1ccc(-c2ccccc2OC(C)C)cc1
InChIInChI=1S/C19H23NO2/c1-13(2)22-19-8-6-5-7-18(19)17-11-9-16(10-12-17)14(3)20-15(4)21/h5-14H,1-4H3,(H,20,21)/t14-/m1/s1
InChIKeyITJZOMLWCPNNEI-CQSZACIVSA-N
MW297.40 g/mol
LogP4.34
Rot. Bonds5

About N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide

N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide (PubChem CID 126444251) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide.

Molecular Properties

Compound NameN-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide
PubChem CID126444251
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide
SMILESCC(=O)N[C@H](C)c1ccc(-c2ccccc2OC(C)C)cc1
InChIInChI=1S/C19H23NO2/c1-13(2)22-19-8-6-5-7-18(19)17-11-9-16(10-12-17)14(3)20-15(4)21/h5-14H,1-4H3,(H,20,21)/t14-/m1/s1
InChIKeyITJZOMLWCPNNEI-CQSZACIVSA-N
XLogP4.34
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide
CID 126444250
N-[(1S)-1-[4-(3-propan-2-yloxyphenyl)phenyl]ethyl]acetamide
CID 126448959
N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide
CID 56706704
N-[(1R)-1-phenylethyl]-2-propan-2-yloxybenzamide
CID 92666015
2-[1-[4-(2-methoxyphenyl)phenyl]ethylcarbamoyl]cyclobutane-1-carboxylic acid
CID 120976401
carbon monoxide;chromium;N-[(1R)-1-phenylethyl]acetamide
CID 14362564
7-amino-N-[1-[4-(2-methoxyphenyl)phenyl]ethyl]heptanamide
CID 119802470
N-[(1R)-1-[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]ethyl]acetamide
CID 97455580
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(2-phenylphenoxy)acetamide
CID 7948811
N-[(1S)-1-[4-(1,2,3,4-tetrahydroisoquinolin-5-yl)phenyl]ethyl]acetamide
CID 95556788
4-[4-(2-propan-2-yloxyphenyl)phenoxy]butanoic acid
CID 87055143
(2S)-N-[(1S)-1-(4-methylphenyl)ethyl]-2-naphthalen-1-yloxypropanamide
CID 28569351

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide?
The IUPAC name of N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide (CID 126444251) is N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide.
What is the SMILES notation for N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide?
The canonical SMILES for N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide is CC(=O)N[C@H](C)c1ccc(-c2ccccc2OC(C)C)cc1.
What is the InChIKey of N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide?
The InChIKey is ITJZOMLWCPNNEI-CQSZACIVSA-N. The full InChI is InChI=1S/C19H23NO2/c1-13(2)22-19-8-6-5-7-18(19)17-11-9-16(10-12-17)14(3)20-15(4)21/h5-14H,1-4H3,(H,20,21)/t14-/m1/s1.
What are the key properties of N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide?
N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide has a molecular weight of 297.40 g/mol, XLogP of 4.34, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-[4-(2-propan-2-yloxyphenyl)phenyl]ethyl]acetamide is sourced from PubChem (CID 126444251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).