N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide

C18H22N2O2 — CID 36860720

IUPACN-(4-methylphenyl)-2-(3-propoxyanilino)acetamide
SMILESCCCOc1cccc(NCC(=O)Nc2ccc(C)cc2)c1
InChIInChI=1S/C18H22N2O2/c1-3-11-22-17-6-4-5-16(12-17)19-13-18(21)20-15-9-7-14(2)8-10-15/h4-10,12,19H,3,11,13H2,1-2H3,(H,20,21)
InChIKeyNFDGUIJLNOIKRB-UHFFFAOYSA-N
MW298.39 g/mol
LogP3.83
Rot. Bonds7

About N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide

N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide (PubChem CID 36860720) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-2-(3-propoxyanilino)acetamide
PubChem CID36860720
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-(4-methylphenyl)-2-(3-propoxyanilino)acetamide
SMILESCCCOc1cccc(NCC(=O)Nc2ccc(C)cc2)c1
InChIInChI=1S/C18H22N2O2/c1-3-11-22-17-6-4-5-16(12-17)19-13-18(21)20-15-9-7-14(2)8-10-15/h4-10,12,19H,3,11,13H2,1-2H3,(H,20,21)
InChIKeyNFDGUIJLNOIKRB-UHFFFAOYSA-N
XLogP3.83
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[2-(3-propoxyanilino)acetyl]amino]phenyl]propanamide
CID 54825188
2-(4-butoxyanilino)-N-(3-propoxyphenyl)acetamide
CID 54820125
N,N-dimethyl-4-[[2-(3-propoxyanilino)acetyl]amino]benzamide
CID 36860927
2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide
CID 54830279
2-(4-methylanilino)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54813929
2-(3-chloro-4-methylanilino)-N-(3-propoxyphenyl)acetamide
CID 54815945
N-(3-prop-2-enoxyphenyl)-2-(3-propoxyanilino)acetamide
CID 54824851
N-[3-(2-methoxyethoxy)phenyl]-2-(4-propoxyanilino)acetamide
CID 54820051
N-[3-(2-methylprop-2-enoxy)phenyl]-2-(3-propoxyanilino)acetamide
CID 54824758
N-(4-butoxyphenyl)-2-(3-methoxyanilino)acetamide
CID 54814474
N-(4-ethoxyphenyl)-2-(3-heptoxyanilino)acetamide
CID 54829289
propyl 4-[[2-oxo-2-(3-propoxyanilino)ethyl]amino]benzoate
CID 54812726

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide?
The IUPAC name of N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide (CID 36860720) is N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide.
What is the SMILES notation for N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide?
The canonical SMILES for N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide is CCCOc1cccc(NCC(=O)Nc2ccc(C)cc2)c1.
What is the InChIKey of N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide?
The InChIKey is NFDGUIJLNOIKRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-3-11-22-17-6-4-5-16(12-17)19-13-18(21)20-15-9-7-14(2)8-10-15/h4-10,12,19H,3,11,13H2,1-2H3,(H,20,21).
What are the key properties of N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide?
N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide has a molecular weight of 298.39 g/mol, XLogP of 3.83, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide is sourced from PubChem (CID 36860720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).