(2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide

C10H14N2O2 — CID 131101010

IUPAC(2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide
SMILESCCNC(=O)[C@@H](N)c1ccc(O)cc1
InChIInChI=1S/C10H14N2O2/c1-2-12-10(14)9(11)7-3-5-8(13)6-4-7/h3-6,9,13H,2,11H2,1H3,(H,12,14)/t9-/m0/s1
InChIKeyKDGNCIUOEFBNJX-VIFPVBQESA-N
MW194.23 g/mol
LogP0.53
Rot. Bonds3

About (2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide

(2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide (PubChem CID 131101010) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is (2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide.

Molecular Properties

Compound Name(2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide
PubChem CID131101010
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name(2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide
SMILESCCNC(=O)[C@@H](N)c1ccc(O)cc1
InChIInChI=1S/C10H14N2O2/c1-2-12-10(14)9(11)7-3-5-8(13)6-4-7/h3-6,9,13H,2,11H2,1H3,(H,12,14)/t9-/m0/s1
InChIKeyKDGNCIUOEFBNJX-VIFPVBQESA-N
XLogP0.53
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide?
The IUPAC name of (2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide (CID 131101010) is (2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide.
What is the SMILES notation for (2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide?
The canonical SMILES for (2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide is CCNC(=O)[C@@H](N)c1ccc(O)cc1.
What is the InChIKey of (2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide?
The InChIKey is KDGNCIUOEFBNJX-VIFPVBQESA-N. The full InChI is InChI=1S/C10H14N2O2/c1-2-12-10(14)9(11)7-3-5-8(13)6-4-7/h3-6,9,13H,2,11H2,1H3,(H,12,14)/t9-/m0/s1.
What are the key properties of (2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide?
(2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide has a molecular weight of 194.23 g/mol, XLogP of 0.53, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-ethyl-2-(4-hydroxyphenyl)acetamide is sourced from PubChem (CID 131101010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).