(2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide

C15H24N2O2 — CID 107734446

IUPAC(2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide
SMILESCCN(C(=O)[C@@H](N)CC(C)C)c1cc(O)ccc1C
InChIInChI=1S/C15H24N2O2/c1-5-17(15(19)13(16)8-10(2)3)14-9-12(18)7-6-11(14)4/h6-7,9-10,13,18H,5,8,16H2,1-4H3/t13-/m0/s1
InChIKeyYSRZYZAJWVBCGE-ZDUSSCGKSA-N
MW264.37 g/mol
LogP2.43
Rot. Bonds5

About (2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide

(2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide (PubChem CID 107734446) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is (2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide
PubChem CID107734446
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name(2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide
SMILESCCN(C(=O)[C@@H](N)CC(C)C)c1cc(O)ccc1C
InChIInChI=1S/C15H24N2O2/c1-5-17(15(19)13(16)8-10(2)3)14-9-12(18)7-6-11(14)4/h6-7,9-10,13,18H,5,8,16H2,1-4H3/t13-/m0/s1
InChIKeyYSRZYZAJWVBCGE-ZDUSSCGKSA-N
XLogP2.43
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
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

2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide
CID 107734495
4-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylbutanamide
CID 107734511
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide
CID 43210202
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-(propan-2-ylamino)acetamide
CID 107734471
2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-(1-methylpyrazol-4-yl)acetamide
CID 107734513
4-[[ethyl-(5-hydroxy-2-methylphenyl)carbamoyl]amino]pentanoic acid
CID 107737106
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)-4-iodobenzamide
CID 28978793
N-ethyl-N-(5-hydroxy-2-methylphenyl)heptanamide
CID 114753046
2-[[ethyl-(5-hydroxy-2-methylphenyl)carbamoyl]amino]acetic acid
CID 107737112

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide?
The IUPAC name of (2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide (CID 107734446) is (2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide.
What is the SMILES notation for (2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide?
The canonical SMILES for (2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide is CCN(C(=O)[C@@H](N)CC(C)C)c1cc(O)ccc1C.
What is the InChIKey of (2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide?
The InChIKey is YSRZYZAJWVBCGE-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-17(15(19)13(16)8-10(2)3)14-9-12(18)7-6-11(14)4/h6-7,9-10,13,18H,5,8,16H2,1-4H3/t13-/m0/s1.
What are the key properties of (2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide?
(2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide has a molecular weight of 264.37 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide is sourced from PubChem (CID 107734446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).