5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine

C13H17N3 — CID 106567449

IUPAC5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine
SMILESCc1cnc(NC(C)c2ccccc2C)[nH]1
InChIInChI=1S/C13H17N3/c1-9-6-4-5-7-12(9)11(3)16-13-14-8-10(2)15-13/h4-8,11H,1-3H3,(H2,14,15,16)
InChIKeyPMSCDUFATGMLDR-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.20
Rot. Bonds3

About 5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine

5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine (PubChem CID 106567449) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is 5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine
PubChem CID106567449
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC Name5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine
SMILESCc1cnc(NC(C)c2ccccc2C)[nH]1
InChIInChI=1S/C13H17N3/c1-9-6-4-5-7-12(9)11(3)16-13-14-8-10(2)15-13/h4-8,11H,1-3H3,(H2,14,15,16)
InChIKeyPMSCDUFATGMLDR-UHFFFAOYSA-N
XLogP3.20
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-5-methyl-1H-imidazol-2-amine
CID 106565436
N-[1-(3-chlorophenyl)ethyl]-5-methyl-1H-imidazol-2-amine
CID 106566722
N-(2,6-dimethylphenyl)-5-methyl-1H-imidazol-2-amine
CID 106559790
3,6-dimethyl-N-[1-(2-methylphenyl)ethyl]pyrazin-2-amine
CID 60703972
5-chloro-4-N-[1-(2-methylphenyl)ethyl]pyrimidine-2,4-diamine
CID 80801728
2-methyl-N-[1-(2-methylphenyl)ethyl]pyridin-3-amine
CID 79041978
N-[1-(2-methylphenyl)ethyl]quinolin-3-amine
CID 43691256
5-chloro-2-methoxy-N-[(1R)-1-(2-methylphenyl)ethyl]pyrimidin-4-amine
CID 96542363
N-[1-(2-methylphenyl)ethyl]-5-(trifluoromethyl)pyridin-2-amine
CID 60703918
6-N-methyl-4-N-[1-(2-methylphenyl)ethyl]pyrimidine-4,6-diamine
CID 80801495
5-bromo-4-N-[1-(2-methylphenyl)ethyl]pyrimidine-2,4-diamine
CID 80801571
2-N,2-N-diethyl-5-N-[1-(2-methylphenyl)ethyl]pyridine-2,5-diamine
CID 43697435

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine?
The IUPAC name of 5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine (CID 106567449) is 5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine.
What is the SMILES notation for 5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine?
The canonical SMILES for 5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine is Cc1cnc(NC(C)c2ccccc2C)[nH]1.
What is the InChIKey of 5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine?
The InChIKey is PMSCDUFATGMLDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c1-9-6-4-5-7-12(9)11(3)16-13-14-8-10(2)15-13/h4-8,11H,1-3H3,(H2,14,15,16).
What are the key properties of 5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine?
5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine has a molecular weight of 215.30 g/mol, XLogP of 3.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[1-(2-methylphenyl)ethyl]-1H-imidazol-2-amine is sourced from PubChem (CID 106567449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).