[1-(4-chlorophenyl)imidazol-2-yl]methanamine

C10H10ClN3 — CID 67564899

IUPAC[1-(4-chlorophenyl)imidazol-2-yl]methanamine
SMILESNCc1nccn1-c1ccc(Cl)cc1
InChIInChI=1S/C10H10ClN3/c11-8-1-3-9(4-2-8)14-6-5-13-10(14)7-12/h1-6H,7,12H2
InChIKeyJOHNFNOFKOEJRH-UHFFFAOYSA-N
MW207.66 g/mol
LogP1.98
Rot. Bonds2

About [1-(4-chlorophenyl)imidazol-2-yl]methanamine

[1-(4-chlorophenyl)imidazol-2-yl]methanamine (PubChem CID 67564899) has the molecular formula C10H10ClN3 and a molecular weight of 207.66 g/mol. Its IUPAC name is [1-(4-chlorophenyl)imidazol-2-yl]methanamine.

Molecular Properties

Compound Name[1-(4-chlorophenyl)imidazol-2-yl]methanamine
PubChem CID67564899
Molecular FormulaC10H10ClN3
Molecular Weight207.66 g/mol
Exact Mass207.06
IUPAC Name[1-(4-chlorophenyl)imidazol-2-yl]methanamine
SMILESNCc1nccn1-c1ccc(Cl)cc1
InChIInChI=1S/C10H10ClN3/c11-8-1-3-9(4-2-8)14-6-5-13-10(14)7-12/h1-6H,7,12H2
InChIKeyJOHNFNOFKOEJRH-UHFFFAOYSA-N
XLogP1.98
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.66
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(3-chloro-4-fluorophenyl)imidazol-2-yl]methanamine
CID 82287676
(1-phenylimidazol-2-yl)methanamine;hydrochloride
CID 162422854
1-[1-(4-chlorophenyl)imidazol-2-yl]-N-methylmethanamine
CID 83890401
1-(4-chlorophenyl)imidazol-2-amine
CID 106558475
2-[1-(3-chlorophenyl)imidazol-2-yl]ethanamine
CID 82286818
2-(1-pyridin-4-ylimidazol-2-yl)ethanamine
CID 62409640
1-(4-chlorophenyl)-2-methylsulfonylimidazole
CID 82132275
[1-(3-chloro-2-methylphenyl)imidazol-2-yl]methanamine
CID 82286820
[1-(4-aminophenyl)imidazol-2-yl]methanol
CID 59577798
4-chloro-2-[[1-[4-(trifluoromethyl)phenyl]imidazol-2-yl]methyl]phenol
CID 10948169
[1-(4-chlorophenyl)tetrazol-5-yl]methanamine;hydrochloride
CID 71779054
2-[4-(2-methylimidazol-1-yl)phenyl]ethanamine
CID 63817285

Frequently Asked Questions

What is the IUPAC name of [1-(4-chlorophenyl)imidazol-2-yl]methanamine?
The IUPAC name of [1-(4-chlorophenyl)imidazol-2-yl]methanamine (CID 67564899) is [1-(4-chlorophenyl)imidazol-2-yl]methanamine.
What is the SMILES notation for [1-(4-chlorophenyl)imidazol-2-yl]methanamine?
The canonical SMILES for [1-(4-chlorophenyl)imidazol-2-yl]methanamine is NCc1nccn1-c1ccc(Cl)cc1.
What is the InChIKey of [1-(4-chlorophenyl)imidazol-2-yl]methanamine?
The InChIKey is JOHNFNOFKOEJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3/c11-8-1-3-9(4-2-8)14-6-5-13-10(14)7-12/h1-6H,7,12H2.
What are the key properties of [1-(4-chlorophenyl)imidazol-2-yl]methanamine?
[1-(4-chlorophenyl)imidazol-2-yl]methanamine has a molecular weight of 207.66 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chlorophenyl)imidazol-2-yl]methanamine is sourced from PubChem (CID 67564899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).