2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline

C10H9F2N3 — CID 174721174

IUPAC2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline
SMILESCNc1c(F)cc(-c2ncc[nH]2)cc1F
InChIInChI=1S/C10H9F2N3/c1-13-9-7(11)4-6(5-8(9)12)10-14-2-3-15-10/h2-5,13H,1H3,(H,14,15)
InChIKeyNLSRYNFSUZRUAM-UHFFFAOYSA-N
MW209.20 g/mol
LogP2.40
Rot. Bonds2

About 2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline

2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline (PubChem CID 174721174) has the molecular formula C10H9F2N3 and a molecular weight of 209.20 g/mol. Its IUPAC name is 2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline.

Molecular Properties

Compound Name2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline
PubChem CID174721174
Molecular FormulaC10H9F2N3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC Name2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline
SMILESCNc1c(F)cc(-c2ncc[nH]2)cc1F
InChIInChI=1S/C10H9F2N3/c1-13-9-7(11)4-6(5-8(9)12)10-14-2-3-15-10/h2-5,13H,1H3,(H,14,15)
InChIKeyNLSRYNFSUZRUAM-UHFFFAOYSA-N
XLogP2.40
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline?
The IUPAC name of 2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline (CID 174721174) is 2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline.
What is the SMILES notation for 2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline?
The canonical SMILES for 2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline is CNc1c(F)cc(-c2ncc[nH]2)cc1F.
What is the InChIKey of 2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline?
The InChIKey is NLSRYNFSUZRUAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N3/c1-13-9-7(11)4-6(5-8(9)12)10-14-2-3-15-10/h2-5,13H,1H3,(H,14,15).
What are the key properties of 2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline?
2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline has a molecular weight of 209.20 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-4-(1H-imidazol-2-yl)-N-methylaniline is sourced from PubChem (CID 174721174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).