2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide

C15H24N2O2 — CID 103833107

IUPAC2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide
SMILESCCC(CC)C(O)CNC(=O)Cc1ccccc1N
InChIInChI=1S/C15H24N2O2/c1-3-11(4-2)14(18)10-17-15(19)9-12-7-5-6-8-13(12)16/h5-8,11,14,18H,3-4,9-10,16H2,1-2H3,(H,17,19)
InChIKeyKZOBLWROXUHFER-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.72
Rot. Bonds7

About 2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide

2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide (PubChem CID 103833107) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide
PubChem CID103833107
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide
SMILESCCC(CC)C(O)CNC(=O)Cc1ccccc1N
InChIInChI=1S/C15H24N2O2/c1-3-11(4-2)14(18)10-17-15(19)9-12-7-5-6-8-13(12)16/h5-8,11,14,18H,3-4,9-10,16H2,1-2H3,(H,17,19)
InChIKeyKZOBLWROXUHFER-UHFFFAOYSA-N
XLogP1.72
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(2,3-difluorophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide
CID 103747763
2-(2-aminophenyl)-N-(2-hydroxy-2-phenylethyl)acetamide
CID 43498529
N-(3-ethyl-2-hydroxypentyl)-3-(2-methylphenyl)propanamide
CID 103658237
2-(2-aminophenyl)-N-(2-methylsulfinylpropyl)acetamide
CID 115976838
2-(3-chlorophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide
CID 103658434
2-chloro-N-[2-[[(2S)-3-ethyl-2-hydroxypentyl]amino]-2-oxoethyl]benzamide
CID 95622425
3-[[2-(2-aminophenyl)acetyl]amino]-N-butan-2-ylpropanamide
CID 61140780
1-(3-ethyl-2-hydroxypentyl)-3-[(2-methoxyphenyl)methyl]urea
CID 111115085
2-(2-aminophenyl)-N-methylacetamide
CID 16772909
2-(2-aminophenyl)-N-prop-2-ynylacetamide
CID 61118028
3-(2-aminophenyl)-N-(2-ethyl-4-hydroxybutyl)propanamide;hydrochloride
CID 120610920
methyl 2-[[2-(2-aminophenyl)acetyl]amino]acetate
CID 16773515

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide?
The IUPAC name of 2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide (CID 103833107) is 2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide is CCC(CC)C(O)CNC(=O)Cc1ccccc1N.
What is the InChIKey of 2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide?
The InChIKey is KZOBLWROXUHFER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-11(4-2)14(18)10-17-15(19)9-12-7-5-6-8-13(12)16/h5-8,11,14,18H,3-4,9-10,16H2,1-2H3,(H,17,19).
What are the key properties of 2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide?
2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.72, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide is sourced from PubChem (CID 103833107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).