3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine

C10H17N3 — CID 105083357

IUPAC3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine
SMILESCc1cnc(C(N)CC(C)C)cn1
InChIInChI=1S/C10H17N3/c1-7(2)4-9(11)10-6-12-8(3)5-13-10/h5-7,9H,4,11H2,1-3H3
InChIKeyNWNRFOHSEYDXFO-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.83
Rot. Bonds3

About 3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine

3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine (PubChem CID 105083357) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine.

Molecular Properties

Compound Name3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine
PubChem CID105083357
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine
SMILESCc1cnc(C(N)CC(C)C)cn1
InChIInChI=1S/C10H17N3/c1-7(2)4-9(11)10-6-12-8(3)5-13-10/h5-7,9H,4,11H2,1-3H3
InChIKeyNWNRFOHSEYDXFO-UHFFFAOYSA-N
XLogP1.83
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-methylpyrazin-2-yl)hexan-1-amine
CID 105129918
2,2-dimethyl-1-(5-methylpyrazin-2-yl)propan-1-amine
CID 105146061
2-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine
CID 105170576
2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine
CID 105139032
1-(5-methylpyrazin-2-yl)octan-1-amine
CID 105124976
1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine
CID 105114103
(1R)-3-methyl-1-(6-methyl-2-pyridinyl)butan-1-amine
CID 96644382
2-(5-chlorothiophen-2-yl)-1-(5-methylpyrazin-2-yl)ethanamine
CID 105135301
1-(5-methylpyrazin-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 105147912
2-(2-chloro-3-fluorophenyl)-1-(5-methylpyrazin-2-yl)ethanamine
CID 105178948
(5-methylpyrazin-2-yl)methanamine
CID 2756496
2,5-dimethylpyrazine;ethane
CID 143125119

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine?
The IUPAC name of 3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine (CID 105083357) is 3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine.
What is the SMILES notation for 3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine?
The canonical SMILES for 3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine is Cc1cnc(C(N)CC(C)C)cn1.
What is the InChIKey of 3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine?
The InChIKey is NWNRFOHSEYDXFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-7(2)4-9(11)10-6-12-8(3)5-13-10/h5-7,9H,4,11H2,1-3H3.
What are the key properties of 3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine?
3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine has a molecular weight of 179.27 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(5-methylpyrazin-2-yl)butan-1-amine is sourced from PubChem (CID 105083357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).