N,2-dimethyl-1-phenylimidazol-4-amine

C11H13N3 — CID 23064547

IUPACN,2-dimethyl-1-phenylimidazol-4-amine
SMILESCNc1cn(-c2ccccc2)c(C)n1
InChIInChI=1S/C11H13N3/c1-9-13-11(12-2)8-14(9)10-6-4-3-5-7-10/h3-8,12H,1-2H3
InChIKeyKGQIPWBGKNYKBQ-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.22
Rot. Bonds2

About N,2-dimethyl-1-phenylimidazol-4-amine

N,2-dimethyl-1-phenylimidazol-4-amine (PubChem CID 23064547) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is N,2-dimethyl-1-phenylimidazol-4-amine.

Molecular Properties

Compound NameN,2-dimethyl-1-phenylimidazol-4-amine
PubChem CID23064547
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC NameN,2-dimethyl-1-phenylimidazol-4-amine
SMILESCNc1cn(-c2ccccc2)c(C)n1
InChIInChI=1S/C11H13N3/c1-9-13-11(12-2)8-14(9)10-6-4-3-5-7-10/h3-8,12H,1-2H3
InChIKeyKGQIPWBGKNYKBQ-UHFFFAOYSA-N
XLogP2.22
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methyl-4-nitro-1-(4-nitrophenyl)-1H-imidazole
CID 71900
1-Phenylimidazole
CID 81595
1-(4-Chlorophenyl)-1H-imidazole
CID 142859
4-(2-methyl-1H-imidazol-1-yl)aniline
CID 3157478
3-(1H-Imidazol-1-ylmethyl)aniline
CID 6481821
4-(1H-imidazol-1-yl)aniline
CID 320165
2-(1H-imidazol-2-yl)pyridine
CID 589313
1-(4-Aminobenzyl)-1H-imidazole
CID 1265319
1-(3-Chlorophenyl)-1H-imidazole
CID 99349
1-(4-Fluorophenyl)imidazole
CID 140833
1',3'-Dihydrospiro(cyclohexane-1,2'-(2H)imidazo(4,5-b)pyridine)
CID 589729
2-N-phenylpyridine-2,3-diamine
CID 10679091

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-1-phenylimidazol-4-amine?
The IUPAC name of N,2-dimethyl-1-phenylimidazol-4-amine (CID 23064547) is N,2-dimethyl-1-phenylimidazol-4-amine.
What is the SMILES notation for N,2-dimethyl-1-phenylimidazol-4-amine?
The canonical SMILES for N,2-dimethyl-1-phenylimidazol-4-amine is CNc1cn(-c2ccccc2)c(C)n1.
What is the InChIKey of N,2-dimethyl-1-phenylimidazol-4-amine?
The InChIKey is KGQIPWBGKNYKBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-9-13-11(12-2)8-14(9)10-6-4-3-5-7-10/h3-8,12H,1-2H3.
What are the key properties of N,2-dimethyl-1-phenylimidazol-4-amine?
N,2-dimethyl-1-phenylimidazol-4-amine has a molecular weight of 187.25 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-1-phenylimidazol-4-amine is sourced from PubChem (CID 23064547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).