2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide

C15H24N2O2 — CID 107734495

IUPAC2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide
SMILESCCN(C(=O)C(N)C(C)(C)C)c1cc(O)ccc1C
InChIInChI=1S/C15H24N2O2/c1-6-17(14(19)13(16)15(3,4)5)12-9-11(18)8-7-10(12)2/h7-9,13,18H,6,16H2,1-5H3
InChIKeyYINBCZMPDSHDPR-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.43
Rot. Bonds3

About 2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide

2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide (PubChem CID 107734495) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide.

Molecular Properties

Compound Name2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide
PubChem CID107734495
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide
SMILESCCN(C(=O)C(N)C(C)(C)C)c1cc(O)ccc1C
InChIInChI=1S/C15H24N2O2/c1-6-17(14(19)13(16)15(3,4)5)12-9-11(18)8-7-10(12)2/h7-9,13,18H,6,16H2,1-5H3
InChIKeyYINBCZMPDSHDPR-UHFFFAOYSA-N
XLogP2.43
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide
CID 107734446
4-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylbutanamide
CID 107734511
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide
CID 43210202
2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-(1-methylpyrazol-4-yl)acetamide
CID 107734513
N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-iodobenzamide
CID 28978793
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-(propan-2-ylamino)acetamide
CID 107734471
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66477100
2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-methylbenzamide
CID 107733112
4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide
CID 107733330
N-ethyl-N-(5-hydroxy-2-methylphenyl)heptanamide
CID 114753046
2-[[ethyl-(5-hydroxy-2-methylphenyl)carbamoyl]amino]acetic acid
CID 107737112
1-carbamothioyl-N-ethyl-N-(5-hydroxy-2-methylphenyl)cyclopropane-1-carboxamide
CID 107735320

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide?
The IUPAC name of 2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide (CID 107734495) is 2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide.
What is the SMILES notation for 2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide?
The canonical SMILES for 2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide is CCN(C(=O)C(N)C(C)(C)C)c1cc(O)ccc1C.
What is the InChIKey of 2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide?
The InChIKey is YINBCZMPDSHDPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-6-17(14(19)13(16)15(3,4)5)12-9-11(18)8-7-10(12)2/h7-9,13,18H,6,16H2,1-5H3.
What are the key properties of 2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide?
2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide has a molecular weight of 264.37 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide is sourced from PubChem (CID 107734495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).