2-benzyl-2-(4-hydroxyphenyl)hexanamide

C19H23NO2 — CID 70049047

IUPAC2-benzyl-2-(4-hydroxyphenyl)hexanamide
SMILESCCCCC(Cc1ccccc1)(C(N)=O)c1ccc(O)cc1
InChIInChI=1S/C19H23NO2/c1-2-3-13-19(18(20)22,14-15-7-5-4-6-8-15)16-9-11-17(21)12-10-16/h4-12,21H,2-3,13-14H2,1H3,(H2,20,22)
InChIKeyGIGQRXRZZBOACG-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.55
Rot. Bonds7

About 2-benzyl-2-(4-hydroxyphenyl)hexanamide

2-benzyl-2-(4-hydroxyphenyl)hexanamide (PubChem CID 70049047) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-benzyl-2-(4-hydroxyphenyl)hexanamide.

Molecular Properties

Compound Name2-benzyl-2-(4-hydroxyphenyl)hexanamide
PubChem CID70049047
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name2-benzyl-2-(4-hydroxyphenyl)hexanamide
SMILESCCCCC(Cc1ccccc1)(C(N)=O)c1ccc(O)cc1
InChIInChI=1S/C19H23NO2/c1-2-3-13-19(18(20)22,14-15-7-5-4-6-8-15)16-9-11-17(21)12-10-16/h4-12,21H,2-3,13-14H2,1H3,(H2,20,22)
InChIKeyGIGQRXRZZBOACG-UHFFFAOYSA-N
XLogP3.55
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-benzylhexanamide
CID 174812463
4-(2-hydroxy-1-phenylundecan-2-yl)phenol
CID 175286085
2-benzyl-5-(methylamino)-2-phenylhexanamide
CID 174298309
2-(4-hydroxyphenyl)-2-methoxyhexanamide
CID 91014466
2-benzyl-2-propylpropanediamide
CID 131715569
3-butyl-3-phenylheptan-2-one
CID 11776692
2,2-diphenylhexanamide;hydrochloride
CID 142429226
(2-benzyl-1-phenylhexan-2-yl)phosphane
CID 118892765
4-[2-[4-[2-(4-hydroxyphenyl)-1-phenylpropan-2-yl]phenyl]-1-phenylpropan-2-yl]phenol
CID 67400035
2-benzyl-2-(hydroxymethoxy)nonanamide
CID 141035749
butyl 2-benzyl-2-butylhexanoate
CID 57035745
2-(4-methylphenyl)-2-phenylhexanamide;hydrochloride
CID 142429224

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-2-(4-hydroxyphenyl)hexanamide?
The IUPAC name of 2-benzyl-2-(4-hydroxyphenyl)hexanamide (CID 70049047) is 2-benzyl-2-(4-hydroxyphenyl)hexanamide.
What is the SMILES notation for 2-benzyl-2-(4-hydroxyphenyl)hexanamide?
The canonical SMILES for 2-benzyl-2-(4-hydroxyphenyl)hexanamide is CCCCC(Cc1ccccc1)(C(N)=O)c1ccc(O)cc1.
What is the InChIKey of 2-benzyl-2-(4-hydroxyphenyl)hexanamide?
The InChIKey is GIGQRXRZZBOACG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-2-3-13-19(18(20)22,14-15-7-5-4-6-8-15)16-9-11-17(21)12-10-16/h4-12,21H,2-3,13-14H2,1H3,(H2,20,22).
What are the key properties of 2-benzyl-2-(4-hydroxyphenyl)hexanamide?
2-benzyl-2-(4-hydroxyphenyl)hexanamide has a molecular weight of 297.40 g/mol, XLogP of 3.55, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-2-(4-hydroxyphenyl)hexanamide is sourced from PubChem (CID 70049047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).