4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine

C14H19N3 — CID 106554707

IUPAC4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine
SMILESCc1cn(-c2ccccc2)c(NCC(C)C)n1
InChIInChI=1S/C14H19N3/c1-11(2)9-15-14-16-12(3)10-17(14)13-7-5-4-6-8-13/h4-8,10-11H,9H2,1-3H3,(H,15,16)
InChIKeyRCGOAEKLTPPVKV-UHFFFAOYSA-N
MW229.33 g/mol
LogP3.25
Rot. Bonds4

About 4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine

4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine (PubChem CID 106554707) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine
PubChem CID106554707
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine
SMILESCc1cn(-c2ccccc2)c(NCC(C)C)n1
InChIInChI=1S/C14H19N3/c1-11(2)9-15-14-16-12(3)10-17(14)13-7-5-4-6-8-13/h4-8,10-11H,9H2,1-3H3,(H,15,16)
InChIKeyRCGOAEKLTPPVKV-UHFFFAOYSA-N
XLogP3.25
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-[2-(2-methylpropoxy)ethyl]-1-phenylimidazol-2-amine
CID 106582396
1-(4-bromo-3-methylphenyl)-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106557033
N',N'-dimethyl-N-(4-methyl-1-phenylimidazol-2-yl)ethane-1,2-diamine
CID 106555123
1-(4-chloro-3-fluorophenyl)-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106567700
N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine
CID 106581312
4-methyl-N-(2-methylsulfinylethyl)-1-phenylimidazol-2-amine
CID 106581417
4-methyl-N-(3-methylsulfinylpropyl)-1-phenylimidazol-2-amine
CID 106580561
4-methyl-1-phenyl-N-(2-thiophen-3-ylethyl)imidazol-2-amine
CID 106567558
1-(2,5-dibromophenyl)-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106566394
1-N,1-N-dimethyl-3-N-(4-methyl-1-phenylimidazol-2-yl)butane-1,3-diamine
CID 106567770
N-[(5-chlorothiophen-2-yl)methyl]-4-methyl-1-phenylimidazol-2-amine
CID 106575438
4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine
CID 106573444

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine?
The IUPAC name of 4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine (CID 106554707) is 4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine.
What is the SMILES notation for 4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine?
The canonical SMILES for 4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine is Cc1cn(-c2ccccc2)c(NCC(C)C)n1.
What is the InChIKey of 4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine?
The InChIKey is RCGOAEKLTPPVKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-11(2)9-15-14-16-12(3)10-17(14)13-7-5-4-6-8-13/h4-8,10-11H,9H2,1-3H3,(H,15,16).
What are the key properties of 4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine?
4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine has a molecular weight of 229.33 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine is sourced from PubChem (CID 106554707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).