2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide

C14H16FN3O — CID 110476005

IUPAC2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide
SMILESCn1ccnc1CCNC(=O)Cc1ccccc1F
InChIInChI=1S/C14H16FN3O/c1-18-9-8-16-13(18)6-7-17-14(19)10-11-4-2-3-5-12(11)15/h2-5,8-9H,6-7,10H2,1H3,(H,17,19)
InChIKeyUYDQLKZGTNXTOQ-UHFFFAOYSA-N
MW261.30 g/mol
LogP1.46
Rot. Bonds5

About 2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide

2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide (PubChem CID 110476005) has the molecular formula C14H16FN3O and a molecular weight of 261.30 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide
PubChem CID110476005
Molecular FormulaC14H16FN3O
Molecular Weight261.30 g/mol
Exact Mass261.13
IUPAC Name2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide
SMILESCn1ccnc1CCNC(=O)Cc1ccccc1F
InChIInChI=1S/C14H16FN3O/c1-18-9-8-16-13(18)6-7-17-14(19)10-11-4-2-3-5-12(11)15/h2-5,8-9H,6-7,10H2,1H3,(H,17,19)
InChIKeyUYDQLKZGTNXTOQ-UHFFFAOYSA-N
XLogP1.46
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-[2-(1-methylimidazol-2-yl)ethyl]benzamide
CID 61215487
2-(4-chlorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide
CID 110476101
N-[2-(1-methylimidazol-2-yl)ethyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 51102467
2-(ethylamino)-3-fluoro-N-[2-(1-methylimidazol-2-yl)ethyl]benzamide
CID 62661928
2-(2-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 78792118
3-[2-(1-methylimidazol-2-yl)ethylamino]-3-oxopropanoic acid
CID 62232290
2-[2-[(1-methylimidazol-2-yl)methylamino]-2-oxoethyl]benzoic acid
CID 104601555
2,3-difluoro-N-[(1-methylimidazol-2-yl)methyl]benzamide
CID 55168082
N-[2-(1-methylimidazol-2-yl)ethyl]-2-(2-methylphenoxy)acetamide
CID 51102465
2-(2,4-difluorophenyl)-N-[(1-methylimidazol-2-yl)methyl]acetamide
CID 110488866
2-ethylsulfonyl-N-[2-(1-methylimidazol-2-yl)ethyl]benzamide
CID 51102554
N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide
CID 62040532

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide (CID 110476005) is 2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide is Cn1ccnc1CCNC(=O)Cc1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide?
The InChIKey is UYDQLKZGTNXTOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O/c1-18-9-8-16-13(18)6-7-17-14(19)10-11-4-2-3-5-12(11)15/h2-5,8-9H,6-7,10H2,1H3,(H,17,19).
What are the key properties of 2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide?
2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide has a molecular weight of 261.30 g/mol, XLogP of 1.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 110476005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).