2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide

C12H18N2O — CID 94681068

IUPAC2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide
SMILESCCc1ccc(CCNC(=O)CN)cc1
InChIInChI=1S/C12H18N2O/c1-2-10-3-5-11(6-4-10)7-8-14-12(15)9-13/h3-6H,2,7-9,13H2,1H3,(H,14,15)
InChIKeyOLKPAMDIQJJJQK-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.87
Rot. Bonds5

About 2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide

2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide (PubChem CID 94681068) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide
PubChem CID94681068
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide
SMILESCCc1ccc(CCNC(=O)CN)cc1
InChIInChI=1S/C12H18N2O/c1-2-10-3-5-11(6-4-10)7-8-14-12(15)9-13/h3-6H,2,7-9,13H2,1H3,(H,14,15)
InChIKeyOLKPAMDIQJJJQK-UHFFFAOYSA-N
XLogP0.87
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide
CID 82492265
3-cyano-N-[2-(4-ethylphenyl)ethyl]propanamide
CID 94685245
3-(4-ethylphenyl)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 94866860
2-amino-N-[2-(4-nitrophenyl)ethyl]acetamide
CID 61218715
5-[2-(4-ethylphenyl)ethylamino]-5-oxopentanoic acid
CID 94693925
N-[2-(4-ethylphenyl)ethyl]-2-(propan-2-ylamino)acetamide
CID 115158289
2-(aminomethyl)-N-[2-(4-ethylphenyl)ethyl]-3-methylbutanamide
CID 115187566
N-[2-(4-ethylphenyl)ethyl]-2-hydroxypropanamide
CID 115140882
(2S)-2-amino-N-[2-(4-ethylphenyl)ethyl]-3-methylbutanamide
CID 94689619
2-amino-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide
CID 60672445
2-amino-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]acetamide
CID 82495829
2-amino-N-[2-(3-methoxy-4-methylphenyl)ethyl]acetamide
CID 119326320

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide?
The IUPAC name of 2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide (CID 94681068) is 2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide is CCc1ccc(CCNC(=O)CN)cc1.
What is the InChIKey of 2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide?
The InChIKey is OLKPAMDIQJJJQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-2-10-3-5-11(6-4-10)7-8-14-12(15)9-13/h3-6H,2,7-9,13H2,1H3,(H,14,15).
What are the key properties of 2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide?
2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide has a molecular weight of 206.29 g/mol, XLogP of 0.87, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide is sourced from PubChem (CID 94681068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).