6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide

C16H26N2O2 — CID 65292067

IUPAC6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide
SMILESCC(C)(CCN)CCC(=O)NCCc1ccc(O)cc1
InChIInChI=1S/C16H26N2O2/c1-16(2,10-11-17)9-7-15(20)18-12-8-13-3-5-14(19)6-4-13/h3-6,19H,7-12,17H2,1-2H3,(H,18,20)
InChIKeyQXYHHNDKKXSTPR-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.21
Rot. Bonds8

About 6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide

6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide (PubChem CID 65292067) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide.

Molecular Properties

Compound Name6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide
PubChem CID65292067
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide
SMILESCC(C)(CCN)CCC(=O)NCCc1ccc(O)cc1
InChIInChI=1S/C16H26N2O2/c1-16(2,10-11-17)9-7-15(20)18-12-8-13-3-5-14(19)6-4-13/h3-6,19H,7-12,17H2,1-2H3,(H,18,20)
InChIKeyQXYHHNDKKXSTPR-UHFFFAOYSA-N
XLogP2.21
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-4,4-dimethyl-N-(3-phenylpropyl)hexanamide
CID 65290908
N-(6-aminohexyl)-N'-[2-(4-hydroxyphenyl)ethyl]dodecanediamide
CID 56967020
N-(6-aminohexyl)-N'-[2-(4-hydroxyphenyl)ethyl]hexanediamide
CID 56967019
N-[2-(4-hydroxyphenyl)ethyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112602898
N-[2-(4-hydroxyphenyl)ethyl]hexanamide
CID 21446637
6-amino-4,4-dimethyl-N-(3,3,3-trifluoropropyl)hexanamide
CID 65291671
7-amino-N-[2-(4-tert-butylphenyl)ethyl]heptanamide
CID 119706715
4-amino-N-[2-(4-fluorophenyl)ethyl]-3,3-dimethylbutanamide
CID 115157410
N-[4-[2-(4-hydroxyphenyl)ethylamino]-4-oxobutyl]docosanamide
CID 59789165
2-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-2-methylpentanamide
CID 67514620
N-[2-(4-ethoxyphenyl)ethyl]-3-(4-hydroxyphenyl)propanamide
CID 174483925
4-amino-N-[2-(4-fluoro-3-methylphenyl)ethyl]-4-methylpentanamide
CID 115157607

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide?
The IUPAC name of 6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide (CID 65292067) is 6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide.
What is the SMILES notation for 6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide?
The canonical SMILES for 6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide is CC(C)(CCN)CCC(=O)NCCc1ccc(O)cc1.
What is the InChIKey of 6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide?
The InChIKey is QXYHHNDKKXSTPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-16(2,10-11-17)9-7-15(20)18-12-8-13-3-5-14(19)6-4-13/h3-6,19H,7-12,17H2,1-2H3,(H,18,20).
What are the key properties of 6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide?
6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide has a molecular weight of 278.40 g/mol, XLogP of 2.21, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[2-(4-hydroxyphenyl)ethyl]-4,4-dimethylhexanamide is sourced from PubChem (CID 65292067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).