N-[4-(butanoylamino)phenyl]butanamide;ethane

C16H26N2O2 — CID 166169399

IUPACN-[4-(butanoylamino)phenyl]butanamide;ethane
SMILESCC.CCCC(=O)Nc1ccc(NC(=O)CCC)cc1
InChIInChI=1S/C14H20N2O2.C2H6/c1-3-5-13(17)15-11-7-9-12(10-8-11)16-14(18)6-4-2;1-2/h7-10H,3-6H2,1-2H3,(H,15,17)(H,16,18);1-2H3
InChIKeyQXYBRYLIODDFJT-UHFFFAOYSA-N
MW278.40 g/mol
LogP4.19
Rot. Bonds6

About N-[4-(butanoylamino)phenyl]butanamide;ethane

N-[4-(butanoylamino)phenyl]butanamide;ethane (PubChem CID 166169399) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[4-(butanoylamino)phenyl]butanamide;ethane.

Molecular Properties

Compound NameN-[4-(butanoylamino)phenyl]butanamide;ethane
PubChem CID166169399
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-[4-(butanoylamino)phenyl]butanamide;ethane
SMILESCC.CCCC(=O)Nc1ccc(NC(=O)CCC)cc1
InChIInChI=1S/C14H20N2O2.C2H6/c1-3-5-13(17)15-11-7-9-12(10-8-11)16-14(18)6-4-2;1-2/h7-10H,3-6H2,1-2H3,(H,15,17)(H,16,18);1-2H3
InChIKeyQXYBRYLIODDFJT-UHFFFAOYSA-N
XLogP4.19
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;N-(4-methylphenyl)butanamide;molecular hydrogen
CID 155712374
N-[4-[[2-(diethylamino)acetyl]amino]phenyl]butanamide
CID 54813705
methyl N-[4-(butanoylamino)phenyl]carbamate
CID 47251296
N-(4-formylphenyl)butanamide
CID 14471017
N-[4-[[2-(4-methylanilino)-2-oxoethyl]amino]phenyl]butanamide
CID 54837141
N-[4-(2-aminoacetyl)phenyl]butanamide
CID 170860322
N-(4-butoxyphenyl)butanamide
CID 4939679
N-[4-(butan-2-ylamino)phenyl]butanamide
CID 112980445
N-[4-[[2-(4-acetamidoanilino)acetyl]amino]phenyl]butanamide
CID 54809172
N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044
(E)-4-[4-(butanoylamino)anilino]-4-oxobut-2-enoic acid
CID 17202441
N-[4-(1,2,2-tricyanoethenylamino)phenyl]butanamide
CID 168609139

Frequently Asked Questions

What is the IUPAC name of N-[4-(butanoylamino)phenyl]butanamide;ethane?
The IUPAC name of N-[4-(butanoylamino)phenyl]butanamide;ethane (CID 166169399) is N-[4-(butanoylamino)phenyl]butanamide;ethane.
What is the SMILES notation for N-[4-(butanoylamino)phenyl]butanamide;ethane?
The canonical SMILES for N-[4-(butanoylamino)phenyl]butanamide;ethane is CC.CCCC(=O)Nc1ccc(NC(=O)CCC)cc1.
What is the InChIKey of N-[4-(butanoylamino)phenyl]butanamide;ethane?
The InChIKey is QXYBRYLIODDFJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2.C2H6/c1-3-5-13(17)15-11-7-9-12(10-8-11)16-14(18)6-4-2;1-2/h7-10H,3-6H2,1-2H3,(H,15,17)(H,16,18);1-2H3.
What are the key properties of N-[4-(butanoylamino)phenyl]butanamide;ethane?
N-[4-(butanoylamino)phenyl]butanamide;ethane has a molecular weight of 278.40 g/mol, XLogP of 4.19, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(butanoylamino)phenyl]butanamide;ethane is sourced from PubChem (CID 166169399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).