2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide

C20H26N2O3 — CID 142030863

IUPAC2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide
SMILESCOc1ccc(Oc2c(C)cc(NC(=O)CN)cc2C)cc1C(C)C
InChIInChI=1S/C20H26N2O3/c1-12(2)17-10-16(6-7-18(17)24-5)25-20-13(3)8-15(9-14(20)4)22-19(23)11-21/h6-10,12H,11,21H2,1-5H3,(H,22,23)
InChIKeyHYEOZFUVZFORGV-UHFFFAOYSA-N
MW342.44 g/mol
LogP4.12
Rot. Bonds6

About 2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide

2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide (PubChem CID 142030863) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is 2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide
PubChem CID142030863
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC Name2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide
SMILESCOc1ccc(Oc2c(C)cc(NC(=O)CN)cc2C)cc1C(C)C
InChIInChI=1S/C20H26N2O3/c1-12(2)17-10-16(6-7-18(17)24-5)25-20-13(3)8-15(9-14(20)4)22-19(23)11-21/h6-10,12H,11,21H2,1-5H3,(H,22,23)
InChIKeyHYEOZFUVZFORGV-UHFFFAOYSA-N
XLogP4.12
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[2-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylanilino]-2-oxoethyl]carbamate
CID 142030848
4-(4-methoxy-3-propan-2-ylphenoxy)-N,3,5-trimethylaniline
CID 11779514
2-acetamido-N-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide
CID 142200859
1-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]-3-(4-methoxyphenyl)urea
CID 142200724
diethyl 4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylbenzene-1,2-dicarboxylate
CID 86626562
O-ethyl [4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]sulfanylmethanethioate
CID 10000485
(4-methoxyphenyl) N-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]carbamate
CID 142200774
N-[4-(3-tert-butyl-4-methoxyphenoxy)-3,5-dimethylphenyl]butanamide;methane
CID 142030854
formaldehyde;N-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide;methanol
CID 143340424
N-[3,5-dichloro-4-(4-methoxy-3-propan-2-ylphenoxy)phenyl]-2-(1-sulfamoylpiperidin-3-yl)acetamide
CID 165166248
methyl 3-(4-methoxy-3-propan-2-ylanilino)-3-oxopropanoate
CID 115174107
1-(3,5-dimethylphenyl)-3-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]urea
CID 10112746

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide?
The IUPAC name of 2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide (CID 142030863) is 2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide.
What is the SMILES notation for 2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide?
The canonical SMILES for 2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide is COc1ccc(Oc2c(C)cc(NC(=O)CN)cc2C)cc1C(C)C.
What is the InChIKey of 2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide?
The InChIKey is HYEOZFUVZFORGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-12(2)17-10-16(6-7-18(17)24-5)25-20-13(3)8-15(9-14(20)4)22-19(23)11-21/h6-10,12H,11,21H2,1-5H3,(H,22,23).
What are the key properties of 2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide?
2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide has a molecular weight of 342.44 g/mol, XLogP of 4.12, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]acetamide is sourced from PubChem (CID 142030863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).