N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide

C16H25NO2 — CID 63821456

IUPACN-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide
SMILESCC(CC(=O)N(C)Cc1ccc(O)cc1)C(C)(C)C
InChIInChI=1S/C16H25NO2/c1-12(16(2,3)4)10-15(19)17(5)11-13-6-8-14(18)9-7-13/h6-9,12,18H,10-11H2,1-5H3
InChIKeyHXSRJVAQUQIVFC-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.42
Rot. Bonds4

About N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide

N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide (PubChem CID 63821456) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide.

Molecular Properties

Compound NameN-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide
PubChem CID63821456
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide
SMILESCC(CC(=O)N(C)Cc1ccc(O)cc1)C(C)(C)C
InChIInChI=1S/C16H25NO2/c1-12(16(2,3)4)10-15(19)17(5)11-13-6-8-14(18)9-7-13/h6-9,12,18H,10-11H2,1-5H3
InChIKeyHXSRJVAQUQIVFC-UHFFFAOYSA-N
XLogP3.42
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[(4-hydroxyphenyl)methyl]-N-methylbutanamide
CID 60963572
3,3,3-trifluoro-N-[(4-hydroxyphenyl)methyl]-N-methylpropanamide
CID 54893745
N-[(4-hydroxyphenyl)methyl]-N-methyl-3-(propan-2-ylamino)propanamide
CID 54873511
(2S)-2-amino-N-[(4-hydroxyphenyl)methyl]-N-methylpropanamide
CID 61146195
(2R)-2-amino-N-[(4-hydroxyphenyl)methyl]-N-methylpropanamide
CID 78973192
N-[(4-hydroxyphenyl)methyl]-N-methyl-4-(propan-2-ylamino)butanamide
CID 54873535
N-(1H-imidazol-2-ylmethyl)-N,3,4,4-tetramethylpentanamide
CID 63939448
N-(2-hydroxyethyl)-N,3,4,4-tetramethylpentanamide
CID 63834183
4-[[3,5-dimethylhexanoyl(methyl)amino]methyl]benzoic acid
CID 119225897
N-[(4-hydroxyphenyl)methyl]-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78960749
methyl N-[(4-hydroxyphenyl)methyl]-N-methylcarbamate
CID 61044601
2-cyclopropyl-N-[(4-hydroxyphenyl)methyl]-N-methylpropanamide
CID 79506391

Frequently Asked Questions

What is the IUPAC name of N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide?
The IUPAC name of N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide (CID 63821456) is N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide.
What is the SMILES notation for N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide?
The canonical SMILES for N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide is CC(CC(=O)N(C)Cc1ccc(O)cc1)C(C)(C)C.
What is the InChIKey of N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide?
The InChIKey is HXSRJVAQUQIVFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-12(16(2,3)4)10-15(19)17(5)11-13-6-8-14(18)9-7-13/h6-9,12,18H,10-11H2,1-5H3.
What are the key properties of N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide?
N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide has a molecular weight of 263.38 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-hydroxyphenyl)methyl]-N,3,4,4-tetramethylpentanamide is sourced from PubChem (CID 63821456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).