2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide

C13H18FN3O2 — CID 103820304

IUPAC2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide
SMILESCCN(C)C(=O)CNCC(=O)Nc1ccccc1F
InChIInChI=1S/C13H18FN3O2/c1-3-17(2)13(19)9-15-8-12(18)16-11-7-5-4-6-10(11)14/h4-7,15H,3,8-9H2,1-2H3,(H,16,18)
InChIKeyQBWSEZOFZXLPAM-UHFFFAOYSA-N
MW267.30 g/mol
LogP0.83
Rot. Bonds6

About 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide

2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide (PubChem CID 103820304) has the molecular formula C13H18FN3O2 and a molecular weight of 267.30 g/mol. Its IUPAC name is 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide
PubChem CID103820304
Molecular FormulaC13H18FN3O2
Molecular Weight267.30 g/mol
Exact Mass267.14
IUPAC Name2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide
SMILESCCN(C)C(=O)CNCC(=O)Nc1ccccc1F
InChIInChI=1S/C13H18FN3O2/c1-3-17(2)13(19)9-15-8-12(18)16-11-7-5-4-6-10(11)14/h4-7,15H,3,8-9H2,1-2H3,(H,16,18)
InChIKeyQBWSEZOFZXLPAM-UHFFFAOYSA-N
XLogP0.83
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.30
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(2-fluoroanilino)-2-oxoethyl]amino]acetic acid
CID 43466135
2-[2-(dimethylamino)ethylamino]-N-(2-fluorophenyl)acetamide
CID 28586883
N-(2-fluorophenyl)-2-(octylamino)acetamide
CID 78914339
2-[[2-(2-fluoroanilino)-2-oxoethyl]amino]-N-(2-methylpropyl)acetamide
CID 115745553
2-[(2-ethoxy-2-methylpropyl)amino]-N-(2-fluorophenyl)acetamide
CID 114941900
2-[[2-(diethylamino)-2-oxoethyl]amino]-N-(2-methylphenyl)acetamide
CID 115745516
2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-(2-fluorophenyl)acetamide
CID 62977435
2-[ethylsulfonyl(methyl)amino]-N-(2-fluorophenyl)acetamide
CID 99818124
2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide
CID 106759760
2-[2-[di(propan-2-yl)amino]ethylamino]-N-(2-fluorophenyl)acetamide
CID 28568733
2-(3-ethylpentan-3-ylamino)-N-(2-fluorophenyl)acetamide
CID 65039803
2-(2-ethylanilino)-N-(2-fluorophenyl)acetamide
CID 9105155

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide (CID 103820304) is 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide is CCN(C)C(=O)CNCC(=O)Nc1ccccc1F.
What is the InChIKey of 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide?
The InChIKey is QBWSEZOFZXLPAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN3O2/c1-3-17(2)13(19)9-15-8-12(18)16-11-7-5-4-6-10(11)14/h4-7,15H,3,8-9H2,1-2H3,(H,16,18).
What are the key properties of 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide?
2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide has a molecular weight of 267.30 g/mol, XLogP of 0.83, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 103820304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).