N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine

C14H19BrN4O — CID 83033299

IUPACN-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine
SMILESCC1(C)CC(NCc2cnc3cnc(Br)cn23)CCO1
InChIInChI=1S/C14H19BrN4O/c1-14(2)5-10(3-4-20-14)16-6-11-7-18-13-8-17-12(15)9-19(11)13/h7-10,16H,3-6H2,1-2H3
InChIKeyYLLJJHUUTMCPKQ-UHFFFAOYSA-N
MW339.24 g/mol
LogP2.54
Rot. Bonds3

About N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine

N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine (PubChem CID 83033299) has the molecular formula C14H19BrN4O and a molecular weight of 339.24 g/mol. Its IUPAC name is N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine.

Molecular Properties

Compound NameN-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine
PubChem CID83033299
Molecular FormulaC14H19BrN4O
Molecular Weight339.24 g/mol
Exact Mass338.07
IUPAC NameN-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine
SMILESCC1(C)CC(NCc2cnc3cnc(Br)cn23)CCO1
InChIInChI=1S/C14H19BrN4O/c1-14(2)5-10(3-4-20-14)16-6-11-7-18-13-8-17-12(15)9-19(11)13/h7-10,16H,3-6H2,1-2H3
InChIKeyYLLJJHUUTMCPKQ-UHFFFAOYSA-N
XLogP2.54
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.24
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-4,4-dimethylcyclohexan-1-amine
CID 79166683
N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]cyclooctanamine
CID 79175819
N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-3-methylcyclohexan-1-amine
CID 79176874
N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,6-dimethylpiperidin-1-amine
CID 83009339
[2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol
CID 106359611
1-(6-bromoimidazo[1,2-a]pyrazin-3-yl)-N-[(1-methylcyclobutyl)methyl]methanamine
CID 114107215
(1S)-N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1-cyclohexylethanamine
CID 81387509
2,2-dimethyl-N-[(1-methyltriazol-4-yl)methyl]oxan-4-amine
CID 115563730
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,2-dimethyloxan-4-amine
CID 106369246
N-[(2-tert-butyl-1,3-thiazol-5-yl)methyl]-2,2-dimethyloxan-4-amine
CID 115563595
N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]cyclopentanamine
CID 117256170
N-(furan-2-ylmethyl)-2,2-dimethyloxan-4-amine
CID 2863086

Frequently Asked Questions

What is the IUPAC name of N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine?
The IUPAC name of N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine (CID 83033299) is N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine.
What is the SMILES notation for N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine?
The canonical SMILES for N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine is CC1(C)CC(NCc2cnc3cnc(Br)cn23)CCO1.
What is the InChIKey of N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine?
The InChIKey is YLLJJHUUTMCPKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN4O/c1-14(2)5-10(3-4-20-14)16-6-11-7-18-13-8-17-12(15)9-19(11)13/h7-10,16H,3-6H2,1-2H3.
What are the key properties of N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine?
N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine has a molecular weight of 339.24 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,2-dimethyloxan-4-amine is sourced from PubChem (CID 83033299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).