N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine

C15H25N3O2 — CID 103169401

IUPACN-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine
SMILESCCCNC(CC1CCC1)c1ncc(OC)nc1OC
InChIInChI=1S/C15H25N3O2/c1-4-8-16-12(9-11-6-5-7-11)14-15(20-3)18-13(19-2)10-17-14/h10-12,16H,4-9H2,1-3H3
InChIKeyPDPZIFREPGHVJF-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.72
Rot. Bonds8

About N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine

N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine (PubChem CID 103169401) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine
PubChem CID103169401
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine
SMILESCCCNC(CC1CCC1)c1ncc(OC)nc1OC
InChIInChI=1S/C15H25N3O2/c1-4-8-16-12(9-11-6-5-7-11)14-15(20-3)18-13(19-2)10-17-14/h10-12,16H,4-9H2,1-3H3
InChIKeyPDPZIFREPGHVJF-UHFFFAOYSA-N
XLogP2.72
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3,5-dimethoxypyrazin-2-yl)-3-methyl-N-propylpentan-1-amine
CID 105031186
3-cyclopentyl-1-(3,5-dimethoxypyrazin-2-yl)-N-ethylpropan-1-amine
CID 105031097
1-(3,5-dimethoxypyrazin-2-yl)-4-methoxy-3-methyl-N-propylbutan-1-amine
CID 105178242
N-[1-(3,5-dimethoxypyrazin-2-yl)-2-[(2-methylpropan-2-yl)oxy]ethyl]propan-1-amine
CID 105178294
1-(3,5-dimethoxypyrazin-2-yl)-N-methyl-2-(oxolan-2-yl)ethanamine
CID 105031020
2-cyclopropyl-1-(3,5-dimethoxypyrazin-2-yl)-N-ethylpropan-1-amine
CID 105031029
[1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine
CID 105332275
N-[2-cyclobutyl-1-(2,4-dimethoxyphenyl)ethyl]propan-1-amine
CID 115863794
N-[(3,5-dimethoxypyrazin-2-yl)-(2-methylpyrazol-3-yl)methyl]propan-1-amine
CID 105178358
1-(3,5-dimethoxypyrazin-2-yl)-N-ethyl-3-methylbutan-1-amine
CID 105030945
1-(3,5-dimethoxypyrazin-2-yl)-N-ethyl-2-propoxyethanamine
CID 107946650
N-[(3,5-dimethoxypyrazin-2-yl)-(1-methylimidazol-4-yl)methyl]propan-1-amine
CID 107977129

Frequently Asked Questions

What is the IUPAC name of N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine?
The IUPAC name of N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine (CID 103169401) is N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine is CCCNC(CC1CCC1)c1ncc(OC)nc1OC.
What is the InChIKey of N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine?
The InChIKey is PDPZIFREPGHVJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-4-8-16-12(9-11-6-5-7-11)14-15(20-3)18-13(19-2)10-17-14/h10-12,16H,4-9H2,1-3H3.
What are the key properties of N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine?
N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine has a molecular weight of 279.38 g/mol, XLogP of 2.72, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine is sourced from PubChem (CID 103169401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).