2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine

C12H21N3O — CID 66451958

IUPAC2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine
SMILESCC(C)CNCc1cncc(OC(C)C)n1
InChIInChI=1S/C12H21N3O/c1-9(2)5-13-6-11-7-14-8-12(15-11)16-10(3)4/h7-10,13H,5-6H2,1-4H3
InChIKeyXRDPWLLQCPJGQV-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.01
Rot. Bonds6

About 2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine

2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine (PubChem CID 66451958) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine
PubChem CID66451958
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine
SMILESCC(C)CNCc1cncc(OC(C)C)n1
InChIInChI=1S/C12H21N3O/c1-9(2)5-13-6-11-7-14-8-12(15-11)16-10(3)4/h7-10,13H,5-6H2,1-4H3
InChIKeyXRDPWLLQCPJGQV-UHFFFAOYSA-N
XLogP2.01
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-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-(4-chlorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-1-amine
CID 66450622
N-[[6-(cyclopentylmethoxy)pyrazin-2-yl]methyl]-2-methylpropan-1-amine
CID 66468416
N-[[6-(2-bromophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-1-amine
CID 66450804
N-[[6-[(4-bromophenyl)methoxy]pyrazin-2-yl]methyl]-2-methylpropan-1-amine
CID 82807751
N-[[6-(2,4-difluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-1-amine
CID 66451593
2-methyl-N-[[6-(2-methylsulfanylphenoxy)pyrazin-2-yl]methyl]propan-1-amine
CID 66465227
N-[[6-(4-bromo-2-methylphenoxy)pyrazin-2-yl]methyl]-2-methylpropan-1-amine
CID 66467044
N-[[6-(1,1,1-trifluoropropan-2-yloxy)pyrazin-2-yl]methyl]ethanamine
CID 66467965
N-[[6-(4-bromo-2-chlorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-1-amine
CID 66451225
N-[[6-(2-methylpropoxy)pyrazin-2-yl]methyl]propan-1-amine
CID 66449996
N-(1-cyclopropylethyl)-N-methyl-6-[(2-methylpropylamino)methyl]pyrazin-2-amine
CID 66457805
N-[[6-(2-propan-2-yloxyethoxy)pyrazin-2-yl]methyl]ethanamine
CID 66450004

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine (CID 66451958) is 2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine is CC(C)CNCc1cncc(OC(C)C)n1.
What is the InChIKey of 2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine?
The InChIKey is XRDPWLLQCPJGQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-9(2)5-13-6-11-7-14-8-12(15-11)16-10(3)4/h7-10,13H,5-6H2,1-4H3.
What are the key properties of 2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine?
2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine has a molecular weight of 223.32 g/mol, XLogP of 2.01, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(6-propan-2-yloxypyrazin-2-yl)methyl]propan-1-amine is sourced from PubChem (CID 66451958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).