1-(3-chlorophenyl)imidazol-2-amine

C9H8ClN3 — CID 106558369

IUPAC1-(3-chlorophenyl)imidazol-2-amine
SMILESNc1nccn1-c1cccc(Cl)c1
InChIInChI=1S/C9H8ClN3/c10-7-2-1-3-8(6-7)13-5-4-12-9(13)11/h1-6H,(H2,11,12)
InChIKeyJHDAAXQOPIJBOU-UHFFFAOYSA-N
MW193.64 g/mol
LogP2.11
Rot. Bonds1

About 1-(3-chlorophenyl)imidazol-2-amine

1-(3-chlorophenyl)imidazol-2-amine (PubChem CID 106558369) has the molecular formula C9H8ClN3 and a molecular weight of 193.64 g/mol. Its IUPAC name is 1-(3-chlorophenyl)imidazol-2-amine.

Molecular Properties

Compound Name1-(3-chlorophenyl)imidazol-2-amine
PubChem CID106558369
Molecular FormulaC9H8ClN3
Molecular Weight193.64 g/mol
Exact Mass193.04
IUPAC Name1-(3-chlorophenyl)imidazol-2-amine
SMILESNc1nccn1-c1cccc(Cl)c1
InChIInChI=1S/C9H8ClN3/c10-7-2-1-3-8(6-7)13-5-4-12-9(13)11/h1-6H,(H2,11,12)
InChIKeyJHDAAXQOPIJBOU-UHFFFAOYSA-N
XLogP2.11
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.64
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chlorophenyl)imidazol-2-amine
CID 106558475
1-(3-phenoxyphenyl)imidazol-2-amine
CID 106566517
2-[1-(3-chlorophenyl)imidazol-2-yl]ethanamine
CID 82286818
N-[3-(2-aminoimidazol-1-yl)phenyl]acetamide
CID 106558064
1-(3-chlorophenyl)imidazole-2-carbonitrile
CID 84671921
1-(4-fluoro-3-methylphenyl)imidazol-2-amine
CID 106570575
1-(4-chloro-2-iodophenyl)imidazol-2-amine
CID 107628322
1-(3-chlorophenyl)-2-methylpyrrole
CID 70286034
4-[[1-(3-chlorophenyl)imidazol-2-yl]sulfanylmethyl]pyridin-2-amine
CID 146128776
2-[1-(3-chlorophenyl)pyrrol-2-yl]ethanamine
CID 82286447
1-(3-chlorophenyl)-2-(2-methylprop-2-enylsulfanyl)imidazole
CID 47134933
1-(4-methyl-3-phenylphenyl)imidazol-2-amine
CID 175242078

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)imidazol-2-amine?
The IUPAC name of 1-(3-chlorophenyl)imidazol-2-amine (CID 106558369) is 1-(3-chlorophenyl)imidazol-2-amine.
What is the SMILES notation for 1-(3-chlorophenyl)imidazol-2-amine?
The canonical SMILES for 1-(3-chlorophenyl)imidazol-2-amine is Nc1nccn1-c1cccc(Cl)c1.
What is the InChIKey of 1-(3-chlorophenyl)imidazol-2-amine?
The InChIKey is JHDAAXQOPIJBOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3/c10-7-2-1-3-8(6-7)13-5-4-12-9(13)11/h1-6H,(H2,11,12).
What are the key properties of 1-(3-chlorophenyl)imidazol-2-amine?
1-(3-chlorophenyl)imidazol-2-amine has a molecular weight of 193.64 g/mol, XLogP of 2.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)imidazol-2-amine is sourced from PubChem (CID 106558369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).