[2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine

C11H11ClFN3 — CID 82292580

IUPAC[2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine
SMILESCc1[nH]c(-c2c(F)cccc2Cl)nc1CN
InChIInChI=1S/C11H11ClFN3/c1-6-9(5-14)16-11(15-6)10-7(12)3-2-4-8(10)13/h2-4H,5,14H2,1H3,(H,15,16)
InChIKeyLFMOWEDCUVXRID-UHFFFAOYSA-N
MW239.68 g/mol
LogP2.64
Rot. Bonds2

About [2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine

[2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine (PubChem CID 82292580) has the molecular formula C11H11ClFN3 and a molecular weight of 239.68 g/mol. Its IUPAC name is [2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine.

Molecular Properties

Compound Name[2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine
PubChem CID82292580
Molecular FormulaC11H11ClFN3
Molecular Weight239.68 g/mol
Exact Mass239.06
IUPAC Name[2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine
SMILESCc1[nH]c(-c2c(F)cccc2Cl)nc1CN
InChIInChI=1S/C11H11ClFN3/c1-6-9(5-14)16-11(15-6)10-7(12)3-2-4-8(10)13/h2-4H,5,14H2,1H3,(H,15,16)
InChIKeyLFMOWEDCUVXRID-UHFFFAOYSA-N
XLogP2.64
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.68
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[5-(2-chloro-6-fluorophenyl)-1,3-oxazol-4-yl]methanamine
CID 79139055
[2-(2-chloro-6-fluorophenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine
CID 104840974
[5-methyl-2-(4-propan-2-ylphenyl)-1H-imidazol-4-yl]methanamine
CID 82288528
[5-(2-chloro-6-fluorophenyl)-1,2,4-oxadiazol-3-yl]methanamine
CID 61324775
2-(2-chloro-6-fluorophenyl)-1H-phenanthro[9,10-d]imidazole
CID 24860777
2-(2-chloro-6-fluorophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821953
[3-(2-chloro-6-fluorophenyl)-1,2,4-oxadiazol-5-yl]methanamine
CID 23008074
[2-(4-methoxyphenyl)-5-methyl-1H-imidazol-4-yl]methanamine
CID 82285142
4-amino-3-(4-ethyl-5-methyl-1H-imidazol-2-yl)-5-fluoro-1H-quinolin-2-one
CID 143484905
2-[5-[3-(2-chloro-6-fluorophenyl)-1H-1,2,4-triazol-5-yl]-4-methyl-1,3-thiazol-2-yl]ethanamine
CID 82569599
2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide
CID 59587669
[2-(2,6-difluorophenyl)-1H-benzimidazol-4-yl]methanamine
CID 104721233

Frequently Asked Questions

What is the IUPAC name of [2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine?
The IUPAC name of [2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine (CID 82292580) is [2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine.
What is the SMILES notation for [2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine?
The canonical SMILES for [2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine is Cc1[nH]c(-c2c(F)cccc2Cl)nc1CN.
What is the InChIKey of [2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine?
The InChIKey is LFMOWEDCUVXRID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClFN3/c1-6-9(5-14)16-11(15-6)10-7(12)3-2-4-8(10)13/h2-4H,5,14H2,1H3,(H,15,16).
What are the key properties of [2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine?
[2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine has a molecular weight of 239.68 g/mol, XLogP of 2.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine is sourced from PubChem (CID 82292580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).