N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide

C21H27NO4 — CID 2670812

IUPACN-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCC[C@@H](C)c1ccccc1NC(=O)Cc1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C21H27NO4/c1-6-14(2)16-9-7-8-10-17(16)22-20(23)13-15-11-18(24-3)21(26-5)19(12-15)25-4/h7-12,14H,6,13H2,1-5H3,(H,22,23)/t14-/m1/s1
InChIKeyOBVVSUCAEIXWOJ-CQSZACIVSA-N
MW357.45 g/mol
LogP4.41
Rot. Bonds8

About N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide

N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide (PubChem CID 2670812) has the molecular formula C21H27NO4 and a molecular weight of 357.45 g/mol. Its IUPAC name is N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
PubChem CID2670812
Molecular FormulaC21H27NO4
Molecular Weight357.45 g/mol
Exact Mass357.19
IUPAC NameN-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCC[C@@H](C)c1ccccc1NC(=O)Cc1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C21H27NO4/c1-6-14(2)16-9-7-8-10-17(16)22-20(23)13-15-11-18(24-3)21(26-5)19(12-15)25-4/h7-12,14H,6,13H2,1-5H3,(H,22,23)/t14-/m1/s1
InChIKeyOBVVSUCAEIXWOJ-CQSZACIVSA-N
XLogP4.41
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-butan-2-ylphenyl)-3,4,5-trimethoxybenzamide
CID 11841254
N-(2-butan-2-ylphenyl)-2-(2-methoxyphenyl)acetamide
CID 3725070
N-(2-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2599423
2-[2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]acetic acid
CID 119218478
N-[2-(dimethylamino)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 30875501
N-[2-[(2S)-butan-2-yl]phenyl]-2-(4-fluorophenyl)acetamide
CID 1122525
[2-[2-[(2S)-butan-2-yl]anilino]-2-oxoethyl]-ethyl-[2-(2-methoxyanilino)-2-oxoethyl]azanium
CID 9029857
N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxy-4-methylbenzamide
CID 2669248
[2-[2-[(2R)-butan-2-yl]anilino]-2-oxoethyl] 2-methoxybenzoate
CID 7485747
N-(2,3-difluorophenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 60596443
[2-[2-[(2R)-butan-2-yl]anilino]-2-oxoethyl] 2-(4-methoxyphenyl)acetate
CID 8011834
N-[2-[(2S)-butan-2-yl]phenyl]-2-methylpropanamide
CID 959786

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
The IUPAC name of N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide (CID 2670812) is N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide.
What is the SMILES notation for N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
The canonical SMILES for N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide is CC[C@@H](C)c1ccccc1NC(=O)Cc1cc(OC)c(OC)c(OC)c1.
What is the InChIKey of N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
The InChIKey is OBVVSUCAEIXWOJ-CQSZACIVSA-N. The full InChI is InChI=1S/C21H27NO4/c1-6-14(2)16-9-7-8-10-17(16)22-20(23)13-15-11-18(24-3)21(26-5)19(12-15)25-4/h7-12,14H,6,13H2,1-5H3,(H,22,23)/t14-/m1/s1.
What are the key properties of N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide has a molecular weight of 357.45 g/mol, XLogP of 4.41, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2R)-butan-2-yl]phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide is sourced from PubChem (CID 2670812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).