N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide

C17H19NO3 — CID 122135780

IUPACN-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide
SMILESCOc1ccc(CCCC(=O)Nc2cccc(O)c2)cc1
InChIInChI=1S/C17H19NO3/c1-21-16-10-8-13(9-11-16)4-2-7-17(20)18-14-5-3-6-15(19)12-14/h3,5-6,8-12,19H,2,4,7H2,1H3,(H,18,20)
InChIKeyDGYMUCAANXHOOO-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.36
Rot. Bonds6

About N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide

N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide (PubChem CID 122135780) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide
PubChem CID122135780
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC NameN-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide
SMILESCOc1ccc(CCCC(=O)Nc2cccc(O)c2)cc1
InChIInChI=1S/C17H19NO3/c1-21-16-10-8-13(9-11-16)4-2-7-17(20)18-14-5-3-6-15(19)12-14/h3,5-6,8-12,19H,2,4,7H2,1H3,(H,18,20)
InChIKeyDGYMUCAANXHOOO-UHFFFAOYSA-N
XLogP3.36
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromophenyl)-4-(4-methoxyphenyl)butanamide
CID 838500
4-(4-methoxyphenyl)-N-phenylbutanamide
CID 48980411
N-(3-methoxyphenyl)-4-phenylbutanamide
CID 683926
N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide
CID 2671013
2-[[3-[4-(4-methoxyphenyl)butanoylamino]phenyl]methylsulfanyl]acetic acid
CID 119240560
N-(3-iodophenyl)-3-(4-methoxyphenyl)propanamide
CID 7688847
N-(3-amino-4-methoxyphenyl)-4-(4-methoxyphenyl)butanamide
CID 119418954
N-[(3-hydroxyphenyl)carbamothioyl]-2-(4-methoxyphenyl)acetamide
CID 4939160
N-[3-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]-3-phenylpropanamide
CID 17222836
3-(4-methoxyphenyl)-N-[3-(methylaminomethyl)phenyl]propanamide
CID 119441047
N-(3-hydroxyphenyl)-2-(3-methoxyphenyl)acetamide
CID 28739724
3-[3-(4-methoxyphenyl)propanoylamino]-N-methylbenzamide
CID 17439563

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide?
The IUPAC name of N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide (CID 122135780) is N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide?
The canonical SMILES for N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide is COc1ccc(CCCC(=O)Nc2cccc(O)c2)cc1.
What is the InChIKey of N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide?
The InChIKey is DGYMUCAANXHOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-21-16-10-8-13(9-11-16)4-2-7-17(20)18-14-5-3-6-15(19)12-14/h3,5-6,8-12,19H,2,4,7H2,1H3,(H,18,20).
What are the key properties of N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide?
N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide has a molecular weight of 285.34 g/mol, XLogP of 3.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide is sourced from PubChem (CID 122135780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).