N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine

C16H20FN3 — CID 106564061

IUPACN-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine
SMILESCc1c(F)cccc1-n1ccnc1NC1CCCCC1
InChIInChI=1S/C16H20FN3/c1-12-14(17)8-5-9-15(12)20-11-10-18-16(20)19-13-6-3-2-4-7-13/h5,8-11,13H,2-4,6-7H2,1H3,(H,18,19)
InChIKeyHAPJDYYYDURPTI-UHFFFAOYSA-N
MW273.35 g/mol
LogP4.06
Rot. Bonds3

About N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine

N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine (PubChem CID 106564061) has the molecular formula C16H20FN3 and a molecular weight of 273.35 g/mol. Its IUPAC name is N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine
PubChem CID106564061
Molecular FormulaC16H20FN3
Molecular Weight273.35 g/mol
Exact Mass273.16
IUPAC NameN-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine
SMILESCc1c(F)cccc1-n1ccnc1NC1CCCCC1
InChIInChI=1S/C16H20FN3/c1-12-14(17)8-5-9-15(12)20-11-10-18-16(20)19-13-6-3-2-4-7-13/h5,8-11,13H,2-4,6-7H2,1H3,(H,18,19)
InChIKeyHAPJDYYYDURPTI-UHFFFAOYSA-N
XLogP4.06
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.35
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine?
The IUPAC name of N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine (CID 106564061) is N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine.
What is the SMILES notation for N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine?
The canonical SMILES for N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine is Cc1c(F)cccc1-n1ccnc1NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine?
The InChIKey is HAPJDYYYDURPTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3/c1-12-14(17)8-5-9-15(12)20-11-10-18-16(20)19-13-6-3-2-4-7-13/h5,8-11,13H,2-4,6-7H2,1H3,(H,18,19).
What are the key properties of N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine?
N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine has a molecular weight of 273.35 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-(3-fluoro-2-methylphenyl)imidazol-2-amine is sourced from PubChem (CID 106564061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).