5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine

C16H20BrN3O — CID 62219065

IUPAC5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine
SMILESCCCc1nc(-c2ccc(OC)c(Br)c2)c(N)n1C1CC1
InChIInChI=1S/C16H20BrN3O/c1-3-4-14-19-15(16(18)20(14)11-6-7-11)10-5-8-13(21-2)12(17)9-10/h5,8-9,11H,3-4,6-7,18H2,1-2H3
InChIKeyZYXDDNOJZFTSKX-UHFFFAOYSA-N
MW350.26 g/mol
LogP4.19
Rot. Bonds5

About 5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine

5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine (PubChem CID 62219065) has the molecular formula C16H20BrN3O and a molecular weight of 350.26 g/mol. Its IUPAC name is 5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine.

Molecular Properties

Compound Name5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine
PubChem CID62219065
Molecular FormulaC16H20BrN3O
Molecular Weight350.26 g/mol
Exact Mass349.08
IUPAC Name5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine
SMILESCCCc1nc(-c2ccc(OC)c(Br)c2)c(N)n1C1CC1
InChIInChI=1S/C16H20BrN3O/c1-3-4-14-19-15(16(18)20(14)11-6-7-11)10-5-8-13(21-2)12(17)9-10/h5,8-9,11H,3-4,6-7,18H2,1-2H3
InChIKeyZYXDDNOJZFTSKX-UHFFFAOYSA-N
XLogP4.19
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.26
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyclopropyl-5-(3,4-difluorophenyl)-2-propylimidazol-4-amine
CID 62218355
5-(3-bromo-4-methoxyphenyl)-2-cyclopropyl-3-propylimidazol-4-amine
CID 62220561
5-(3-bromo-4-methoxyphenyl)-3-butyl-2-ethylimidazol-4-amine
CID 62219915
3-cyclopropyl-2-propyl-5-(3,4,5-trifluorophenyl)imidazol-4-amine
CID 63050859
5-(3,4-dimethoxyphenyl)-3-methyl-2-propylimidazol-4-amine
CID 62220657
3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine
CID 55048823
5-(3-bromo-4-methoxyphenyl)-2-cyclopentyl-3-methylimidazol-4-amine
CID 62218652
3-cyclopropyl-2-ethyl-5-(4-propoxyphenyl)imidazol-4-amine
CID 62495279
5-(5-amino-1-cyclopropyl-2-methylimidazol-4-yl)-2-methoxybenzonitrile
CID 65336593
4-(3-bromo-4-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine
CID 106951384
3-cyclopropyl-2-ethyl-5-phenylimidazol-4-amine
CID 62220629
3-cyclopropyl-5-(3-ethylimidazol-4-yl)-2-propylimidazol-4-amine
CID 66135479

Frequently Asked Questions

What is the IUPAC name of 5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine?
The IUPAC name of 5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine (CID 62219065) is 5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine.
What is the SMILES notation for 5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine?
The canonical SMILES for 5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine is CCCc1nc(-c2ccc(OC)c(Br)c2)c(N)n1C1CC1.
What is the InChIKey of 5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine?
The InChIKey is ZYXDDNOJZFTSKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20BrN3O/c1-3-4-14-19-15(16(18)20(14)11-6-7-11)10-5-8-13(21-2)12(17)9-10/h5,8-9,11H,3-4,6-7,18H2,1-2H3.
What are the key properties of 5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine?
5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine has a molecular weight of 350.26 g/mol, XLogP of 4.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine is sourced from PubChem (CID 62219065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).