2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane

C11H18N2O2 — CID 144997622

IUPAC2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane
SMILESCC.NCC(=O)Nc1ccc(CO)cc1
InChIInChI=1S/C9H12N2O2.C2H6/c10-5-9(13)11-8-3-1-7(6-12)2-4-8;1-2/h1-4,12H,5-6,10H2,(H,11,13);1-2H3
InChIKeyZVDCFCKOUBHQJW-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.10
Rot. Bonds3

About 2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane

2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane (PubChem CID 144997622) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane.

Molecular Properties

Compound Name2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane
PubChem CID144997622
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane
SMILESCC.NCC(=O)Nc1ccc(CO)cc1
InChIInChI=1S/C9H12N2O2.C2H6/c10-5-9(13)11-8-3-1-7(6-12)2-4-8;1-2/h1-4,12H,5-6,10H2,(H,11,13);1-2H3
InChIKeyZVDCFCKOUBHQJW-UHFFFAOYSA-N
XLogP1.10
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N-[4-(hydroxymethyl)phenyl]acetamide
CID 23625045
2-amino-N-(4-propylphenyl)acetamide
CID 43216495
N-[4-[(2-aminoacetyl)amino]phenyl]propanamide
CID 43708679
N-[4-(hydroxymethyl)phenyl]-2-methoxyacetamide
CID 64794296
2-amino-N-[4-(ethoxymethyl)phenyl]acetamide
CID 119340719
2-amino-N-[4-(methylcarbamoylamino)phenyl]acetamide
CID 43710915
2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 43708154
3-[4-[(2-aminoacetyl)amino]phenyl]propanoic acid;hydrochloride
CID 54611935
methyl N-[4-(hydroxymethyl)phenyl]carbamate
CID 64793961
(2S)-2-amino-N-[4-(hydroxymethyl)phenyl]propanamide
CID 103691721
N-[4-(hydroxymethyl)phenyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603178
1-[4-(hydroxymethyl)phenyl]-3-(4-methylphenyl)urea
CID 64794146

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane?
The IUPAC name of 2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane (CID 144997622) is 2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane.
What is the SMILES notation for 2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane?
The canonical SMILES for 2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane is CC.NCC(=O)Nc1ccc(CO)cc1.
What is the InChIKey of 2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane?
The InChIKey is ZVDCFCKOUBHQJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2.C2H6/c10-5-9(13)11-8-3-1-7(6-12)2-4-8;1-2/h1-4,12H,5-6,10H2,(H,11,13);1-2H3.
What are the key properties of 2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane?
2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane has a molecular weight of 210.28 g/mol, XLogP of 1.10, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(hydroxymethyl)phenyl]acetamide;ethane is sourced from PubChem (CID 144997622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).