1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine

C14H15Br2N3 — CID 107605114

IUPAC1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine
SMILESBrc1cccc(Br)c1Nc1nccn1C1CCCC1
InChIInChI=1S/C14H15Br2N3/c15-11-6-3-7-12(16)13(11)18-14-17-8-9-19(14)10-4-1-2-5-10/h3,6-10H,1-2,4-5H2,(H,17,18)
InChIKeyWRWFONAJHSXJCB-UHFFFAOYSA-N
MW385.10 g/mol
LogP5.27
Rot. Bonds3

About 1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine

1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine (PubChem CID 107605114) has the molecular formula C14H15Br2N3 and a molecular weight of 385.10 g/mol. Its IUPAC name is 1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine
PubChem CID107605114
Molecular FormulaC14H15Br2N3
Molecular Weight385.10 g/mol
Exact Mass382.96
IUPAC Name1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine
SMILESBrc1cccc(Br)c1Nc1nccn1C1CCCC1
InChIInChI=1S/C14H15Br2N3/c15-11-6-3-7-12(16)13(11)18-14-17-8-9-19(14)10-4-1-2-5-10/h3,6-10H,1-2,4-5H2,(H,17,18)
InChIKeyWRWFONAJHSXJCB-UHFFFAOYSA-N
XLogP5.27
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.10
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Phenylimidazole
CID 81595
(2-Bromo-phenyl)-(1H-imidazol-2-yl)-amine
CID 10490084
1-(4-Bromophenyl)imidazole
CID 2735604
3-bromo-N-(1H-imidazol-5-ylmethyl)-N-propan-2-ylaniline
CID 24948081
1-(3-bromophenyl)-1H-imidazole
CID 312096
1-Phenyl-1H-imidazol-2-amine
CID 13805405
4-bromo-N-(1H-imidazol-5-ylmethyl)-N-propan-2-ylaniline
CID 24948269
2-bromo-1-phenyl-1H-imidazole
CID 45594301
1-(4-Bromophenyl)-4-methyl-1H-imidazole
CID 53415672
(3-(1H-Imidazol-1-yl)propyl)-3-(4-bromophenyl)-2-cyanoguanidine
CID 24858983
4-bromo-N-[(5-chloro-1-methylimidazol-2-yl)methyl]-N-ethylaniline
CID 71935779
N-(3-bromophenyl)-2-(1H-imidazol-1-yl)acetamide
CID 17416414

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine?
The IUPAC name of 1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine (CID 107605114) is 1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine.
What is the SMILES notation for 1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine?
The canonical SMILES for 1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine is Brc1cccc(Br)c1Nc1nccn1C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine?
The InChIKey is WRWFONAJHSXJCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Br2N3/c15-11-6-3-7-12(16)13(11)18-14-17-8-9-19(14)10-4-1-2-5-10/h3,6-10H,1-2,4-5H2,(H,17,18).
What are the key properties of 1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine?
1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine has a molecular weight of 385.10 g/mol, XLogP of 5.27, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-(2,6-dibromophenyl)imidazol-2-amine is sourced from PubChem (CID 107605114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).