N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide

C19H22N2O3 — CID 17202461

IUPACN-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide
SMILESCCCC(=O)Nc1ccc(NC(=O)Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C19H22N2O3/c1-3-4-18(22)20-15-7-9-16(10-8-15)21-19(23)13-14-5-11-17(24-2)12-6-14/h5-12H,3-4,13H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyDFNNCXDBWHXNDM-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.62
Rot. Bonds7

About N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide

N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide (PubChem CID 17202461) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide.

Molecular Properties

Compound NameN-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide
PubChem CID17202461
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide
SMILESCCCC(=O)Nc1ccc(NC(=O)Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C19H22N2O3/c1-3-4-18(22)20-15-7-9-16(10-8-15)21-19(23)13-14-5-11-17(24-2)12-6-14/h5-12H,3-4,13H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyDFNNCXDBWHXNDM-UHFFFAOYSA-N
XLogP3.62
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[[[2-(4-methoxyphenyl)acetyl]amino]carbamoyl]phenyl]butanamide
CID 1011747
N-(4-hexoxyphenyl)-2-(4-methoxyphenyl)acetamide
CID 4939326
N-[4-(2-aminoethyl)phenyl]-2-(4-methoxyphenyl)acetamide
CID 28754535
N-[4-(2-chloroethyl)phenyl]-2-(4-methoxyphenyl)acetamide
CID 114299189
N-(4-methoxyphenyl)-2-pyridin-4-ylacetamide
CID 110697333
N-[2-(4-methoxyanilino)-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 112998708
2-(4-methoxyphenyl)-N-pyridin-4-ylacetamide
CID 4228325
N-(4-methoxyphenyl)-2-(4-methylsulfonylphenyl)acetamide
CID 41139632
2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate
CID 161099806
N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 46484833
N,N'-bis(4-methoxyphenyl)dodecanediamide
CID 5187461
N-[4-(cyclopropylamino)phenyl]-2-(4-methoxyphenyl)acetamide
CID 112979974

Frequently Asked Questions

What is the IUPAC name of N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide?
The IUPAC name of N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide (CID 17202461) is N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide.
What is the SMILES notation for N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide?
The canonical SMILES for N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide is CCCC(=O)Nc1ccc(NC(=O)Cc2ccc(OC)cc2)cc1.
What is the InChIKey of N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide?
The InChIKey is DFNNCXDBWHXNDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-3-4-18(22)20-15-7-9-16(10-8-15)21-19(23)13-14-5-11-17(24-2)12-6-14/h5-12H,3-4,13H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide?
N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide has a molecular weight of 326.40 g/mol, XLogP of 3.62, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide is sourced from PubChem (CID 17202461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).