N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide

C16H17FN2O2 — CID 60927140

IUPACN-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide
SMILESCC(=O)Nc1cc(NC(C)c2ccc(O)cc2)ccc1F
InChIInChI=1S/C16H17FN2O2/c1-10(12-3-6-14(21)7-4-12)18-13-5-8-15(17)16(9-13)19-11(2)20/h3-10,18,21H,1-2H3,(H,19,20)
InChIKeyMGMQPCGQGCONGK-UHFFFAOYSA-N
MW288.32 g/mol
LogP3.66
Rot. Bonds4

About N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide

N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide (PubChem CID 60927140) has the molecular formula C16H17FN2O2 and a molecular weight of 288.32 g/mol. Its IUPAC name is N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide
PubChem CID60927140
Molecular FormulaC16H17FN2O2
Molecular Weight288.32 g/mol
Exact Mass288.13
IUPAC NameN-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide
SMILESCC(=O)Nc1cc(NC(C)c2ccc(O)cc2)ccc1F
InChIInChI=1S/C16H17FN2O2/c1-10(12-3-6-14(21)7-4-12)18-13-5-8-15(17)16(9-13)19-11(2)20/h3-10,18,21H,1-2H3,(H,19,20)
InChIKeyMGMQPCGQGCONGK-UHFFFAOYSA-N
XLogP3.66
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 53.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-fluoro-5-(1-pyridin-4-ylethylamino)phenyl]acetamide
CID 60927576
N-[2-fluoro-5-[1-(5-fluoro-3-pyridinyl)ethylamino]phenyl]acetamide
CID 103935526
N-[2-fluoro-5-[1-(1,3-thiazol-4-yl)ethylamino]phenyl]acetamide
CID 115925911
N-[2-fluoro-5-(1-pyridin-2-ylethylamino)phenyl]acetamide
CID 60928627
(2R)-2-(3-acetamido-4-fluoroanilino)-N,N-di(propan-2-yl)propanamide
CID 37310616
N-[2-fluoro-5-(2-methylpropylamino)phenyl]acetamide
CID 60928010
N-[2-fluoro-5-(nonan-2-ylamino)phenyl]acetamide
CID 60927482
N-(3-acetamido-4-fluorophenyl)-2,2-difluoroacetamide
CID 113220904
N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide
CID 43778944
N-(3-acetamido-4-fluorophenyl)-2-bromo-3-methylbutanamide
CID 43347135
N-[5-[(2,4-dihydroxyphenyl)methylamino]-2-fluorophenyl]acetamide
CID 60928497
methyl 2-(3-acetamido-4-fluoroanilino)butanoate
CID 110209270

Frequently Asked Questions

What is the IUPAC name of N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide?
The IUPAC name of N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide (CID 60927140) is N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide.
What is the SMILES notation for N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide?
The canonical SMILES for N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide is CC(=O)Nc1cc(NC(C)c2ccc(O)cc2)ccc1F.
What is the InChIKey of N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide?
The InChIKey is MGMQPCGQGCONGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O2/c1-10(12-3-6-14(21)7-4-12)18-13-5-8-15(17)16(9-13)19-11(2)20/h3-10,18,21H,1-2H3,(H,19,20).
What are the key properties of N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide?
N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide has a molecular weight of 288.32 g/mol, XLogP of 3.66, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide is sourced from PubChem (CID 60927140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).