N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide

C19H21F3N2O3 — CID 33164006

IUPACN-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide
SMILESCCCOc1ccc(C(F)(F)F)cc1NCC(=O)Nc1cccc(OC)c1
InChIInChI=1S/C19H21F3N2O3/c1-3-9-27-17-8-7-13(19(20,21)22)10-16(17)23-12-18(25)24-14-5-4-6-15(11-14)26-2/h4-8,10-11,23H,3,9,12H2,1-2H3,(H,24,25)
InChIKeyIXCRUJXCLHNKMS-UHFFFAOYSA-N
MW382.38 g/mol
LogP4.55
Rot. Bonds8

About N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide

N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide (PubChem CID 33164006) has the molecular formula C19H21F3N2O3 and a molecular weight of 382.38 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide
PubChem CID33164006
Molecular FormulaC19H21F3N2O3
Molecular Weight382.38 g/mol
Exact Mass382.15
IUPAC NameN-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide
SMILESCCCOc1ccc(C(F)(F)F)cc1NCC(=O)Nc1cccc(OC)c1
InChIInChI=1S/C19H21F3N2O3/c1-3-9-27-17-8-7-13(19(20,21)22)10-16(17)23-12-18(25)24-14-5-4-6-15(11-14)26-2/h4-8,10-11,23H,3,9,12H2,1-2H3,(H,24,25)
InChIKeyIXCRUJXCLHNKMS-UHFFFAOYSA-N
XLogP4.55
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.38
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide
CID 42070595
N-(2-methoxy-4-nitrophenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide
CID 42070606
2-(4-methoxyphenyl)-N-[2-propoxy-5-(trifluoromethyl)phenyl]acetamide
CID 8800716
2-(2,5-dimethoxyanilino)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54814109
N-(3-ethoxyphenyl)-2-[3-(trifluoromethyl)anilino]acetamide
CID 54833710
3,3-dimethyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]butanamide
CID 112765185
3-methoxy-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]benzamide
CID 4880939
2-(4-methoxy-2-methylsulfonylanilino)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 22304612
2-[2-(3-phenylpropoxy)anilino]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 54826954
N-(3-methoxyphenyl)-2-(2-phenylmethoxyanilino)acetamide
CID 54827854
2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide
CID 54824256
2-(2,5-dimethoxyanilino)-N-[3-(3-methylbutoxy)phenyl]acetamide
CID 54814025

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide?
The IUPAC name of N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide (CID 33164006) is N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide is CCCOc1ccc(C(F)(F)F)cc1NCC(=O)Nc1cccc(OC)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide?
The InChIKey is IXCRUJXCLHNKMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F3N2O3/c1-3-9-27-17-8-7-13(19(20,21)22)10-16(17)23-12-18(25)24-14-5-4-6-15(11-14)26-2/h4-8,10-11,23H,3,9,12H2,1-2H3,(H,24,25).
What are the key properties of N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide?
N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide has a molecular weight of 382.38 g/mol, XLogP of 4.55, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-[2-propoxy-5-(trifluoromethyl)anilino]acetamide is sourced from PubChem (CID 33164006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).