6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine

C11H15BrN4 — CID 90183357

IUPAC6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine
SMILESCCNc1nc2cnc(Br)cc2n1C(C)C
InChIInChI=1S/C11H15BrN4/c1-4-13-11-15-8-6-14-10(12)5-9(8)16(11)7(2)3/h5-7H,4H2,1-3H3,(H,13,15)
InChIKeySWVIMUACPGPKGX-UHFFFAOYSA-N
MW283.17 g/mol
LogP3.21
Rot. Bonds3

About 6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine

6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine (PubChem CID 90183357) has the molecular formula C11H15BrN4 and a molecular weight of 283.17 g/mol. Its IUPAC name is 6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine.

Molecular Properties

Compound Name6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine
PubChem CID90183357
Molecular FormulaC11H15BrN4
Molecular Weight283.17 g/mol
Exact Mass282.05
IUPAC Name6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine
SMILESCCNc1nc2cnc(Br)cc2n1C(C)C
InChIInChI=1S/C11H15BrN4/c1-4-13-11-15-8-6-14-10(12)5-9(8)16(11)7(2)3/h5-7H,4H2,1-3H3,(H,13,15)
InChIKeySWVIMUACPGPKGX-UHFFFAOYSA-N
XLogP3.21
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.17
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-bromo-N-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine
CID 90183450
6-bromo-1-propan-2-ylimidazo[4,5-c]pyridine-2-carboxylic acid
CID 90177551
tert-butyl N-[(1S)-1-(6-bromo-1-propan-2-ylimidazo[4,5-c]pyridin-2-yl)ethyl]carbamate
CID 90183375
3-(6-bromo-2-methylimidazo[4,5-c]pyridin-1-yl)butanenitrile
CID 90183960
6-tert-butyl-N,1-di(propan-2-yl)benzimidazol-2-amine
CID 132599814
methyl 2-[2-(ethylamino)-5,6-dimethylbenzimidazol-1-yl]butanoate
CID 82359619
5-bromo-N-ethyl-1-methylimidazol-2-amine
CID 117190521
methyl 2-[2-(ethylamino)benzimidazol-1-yl]propanoate
CID 82359524
N-ethyl-5,6-dimethoxy-1-(3-methylbutyl)benzimidazol-2-amine
CID 82359675
6-bromo-1-methyltriazolo[4,5-c]pyridine
CID 170626731
6-bromo-2-methyl-1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carboxylic acid
CID 90177565
6-bromo-3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine
CID 163320821

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine?
The IUPAC name of 6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine (CID 90183357) is 6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine.
What is the SMILES notation for 6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine?
The canonical SMILES for 6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine is CCNc1nc2cnc(Br)cc2n1C(C)C.
What is the InChIKey of 6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine?
The InChIKey is SWVIMUACPGPKGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN4/c1-4-13-11-15-8-6-14-10(12)5-9(8)16(11)7(2)3/h5-7H,4H2,1-3H3,(H,13,15).
What are the key properties of 6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine?
6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine has a molecular weight of 283.17 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-ethyl-1-propan-2-ylimidazo[4,5-c]pyridin-2-amine is sourced from PubChem (CID 90183357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).