N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide

C16H17NO3 — CID 3801110

IUPACN-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide
SMILESCOc1ccc(C(NC(C)=O)c2ccc(O)cc2)cc1
InChIInChI=1S/C16H17NO3/c1-11(18)17-16(12-3-7-14(19)8-4-12)13-5-9-15(20-2)10-6-13/h3-10,16,19H,1-2H3,(H,17,18)
InChIKeyPWLOSCRIDIQMPR-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.63
Rot. Bonds4

About N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide

N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide (PubChem CID 3801110) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound NameN-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide
PubChem CID3801110
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide
SMILESCOc1ccc(C(NC(C)=O)c2ccc(O)cc2)cc1
InChIInChI=1S/C16H17NO3/c1-11(18)17-16(12-3-7-14(19)8-4-12)13-5-9-15(20-2)10-6-13/h3-10,16,19H,1-2H3,(H,17,18)
InChIKeyPWLOSCRIDIQMPR-UHFFFAOYSA-N
XLogP2.63
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(S)-(4-ethoxyphenyl)-(4-methoxyphenyl)methyl]acetamide
CID 878876
N-[(R)-(4-ethoxyphenyl)-(4-methoxyphenyl)methyl]acetamide
CID 878875
N-[(1R)-1-(4-methoxyphenyl)propyl]acetamide
CID 10774699
N-[bis(4-methoxyphenyl)methyl]-2-(methylamino)acetamide
CID 18197515
N-[bis(4-methoxyphenyl)methyl]-2-chloroacetamide
CID 4962456
[(S)-(4-methoxyphenyl)-phenylmethyl]urea
CID 870966
N-[(4-methoxyphenyl)-phenylmethyl]-2-methylpropanamide
CID 46419913
N-[cyclopropyl-(4-methoxyphenyl)methyl]acetamide
CID 60701170
N-[(4-methoxyphenyl)-(4-propan-2-ylphenyl)methyl]cyclopropanecarboxamide
CID 171097080
methane;4-methoxyphenol
CID 159494332
N-[bis(4-methoxyphenyl)methyl]-2-butoxypropanamide
CID 48658410
2-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)propyl]acetamide
CID 78807011

Frequently Asked Questions

What is the IUPAC name of N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide?
The IUPAC name of N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide (CID 3801110) is N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide?
The canonical SMILES for N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide is COc1ccc(C(NC(C)=O)c2ccc(O)cc2)cc1.
What is the InChIKey of N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide?
The InChIKey is PWLOSCRIDIQMPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-11(18)17-16(12-3-7-14(19)8-4-12)13-5-9-15(20-2)10-6-13/h3-10,16,19H,1-2H3,(H,17,18).
What are the key properties of N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide?
N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide has a molecular weight of 271.32 g/mol, XLogP of 2.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-hydroxyphenyl)-(4-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 3801110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).