N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine

C14H19N3 — CID 106559204

IUPACN-(3,5-dimethylphenyl)-1-propylimidazol-2-amine
SMILESCCCn1ccnc1Nc1cc(C)cc(C)c1
InChIInChI=1S/C14H19N3/c1-4-6-17-7-5-15-14(17)16-13-9-11(2)8-12(3)10-13/h5,7-10H,4,6H2,1-3H3,(H,15,16)
InChIKeyTYDVPPMCIDTSGZ-UHFFFAOYSA-N
MW229.33 g/mol
LogP3.65
Rot. Bonds4

About N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine

N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine (PubChem CID 106559204) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-1-propylimidazol-2-amine
PubChem CID106559204
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC NameN-(3,5-dimethylphenyl)-1-propylimidazol-2-amine
SMILESCCCn1ccnc1Nc1cc(C)cc(C)c1
InChIInChI=1S/C14H19N3/c1-4-6-17-7-5-15-14(17)16-13-9-11(2)8-12(3)10-13/h5,7-10H,4,6H2,1-3H3,(H,15,16)
InChIKeyTYDVPPMCIDTSGZ-UHFFFAOYSA-N
XLogP3.65
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 ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dichloro-4-fluorophenyl)-1-propylimidazol-2-amine
CID 107581375
N-(4-bromo-3,5-dimethylphenyl)-1-butylimidazol-2-amine
CID 107581491
N-(3,4-dichlorophenyl)-1-propylimidazol-2-amine
CID 106557576
1-butyl-N-(3-methylphenyl)imidazol-2-amine
CID 106560213
N-(3-chloro-4-fluorophenyl)-1-propylimidazol-2-amine
CID 106554348
N-(3,5-dimethylphenyl)-1-propan-2-ylimidazol-2-amine
CID 106559222
1-methyl-N-(1-propylimidazol-2-yl)pyrazol-3-amine
CID 106562921
N-(3-fluoro-5-methylphenyl)-1-methylimidazol-2-amine
CID 106576252
N-(2-bromo-6-fluorophenyl)-1-propylimidazol-2-amine
CID 107605154
1-octyl-N-phenylimidazol-2-amine
CID 106578848
N-(2-chloro-5-fluorophenyl)-1-propylimidazol-2-amine
CID 107532048
1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine
CID 106555369

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine?
The IUPAC name of N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine (CID 106559204) is N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine.
What is the SMILES notation for N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine?
The canonical SMILES for N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine is CCCn1ccnc1Nc1cc(C)cc(C)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine?
The InChIKey is TYDVPPMCIDTSGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-4-6-17-7-5-15-14(17)16-13-9-11(2)8-12(3)10-13/h5,7-10H,4,6H2,1-3H3,(H,15,16).
What are the key properties of N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine?
N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine has a molecular weight of 229.33 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine is sourced from PubChem (CID 106559204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).