6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine

C17H21N3 — CID 114606962

IUPAC6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine
SMILESCCCNc1cncc(-c2cccc(C3CCC3)c2)n1
InChIInChI=1S/C17H21N3/c1-2-9-19-17-12-18-11-16(20-17)15-8-4-7-14(10-15)13-5-3-6-13/h4,7-8,10-13H,2-3,5-6,9H2,1H3,(H,19,20)
InChIKeyVCEOTCAYZAZTCO-UHFFFAOYSA-N
MW267.38 g/mol
LogP4.23
Rot. Bonds5

About 6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine

6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine (PubChem CID 114606962) has the molecular formula C17H21N3 and a molecular weight of 267.38 g/mol. Its IUPAC name is 6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine.

Molecular Properties

Compound Name6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine
PubChem CID114606962
Molecular FormulaC17H21N3
Molecular Weight267.38 g/mol
Exact Mass267.17
IUPAC Name6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine
SMILESCCCNc1cncc(-c2cccc(C3CCC3)c2)n1
InChIInChI=1S/C17H21N3/c1-2-9-19-17-12-18-11-16(20-17)15-8-4-7-14(10-15)13-5-3-6-13/h4,7-8,10-13H,2-3,5-6,9H2,1H3,(H,19,20)
InChIKeyVCEOTCAYZAZTCO-UHFFFAOYSA-N
XLogP4.23
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-cyclobutylphenyl)-N-ethylpyrazin-2-amine
CID 116506952
6-(4-cyclopropyloxyphenyl)-N-propylpyrazin-2-amine
CID 114520336
N-propyl-6-(1H-pyrrol-2-yl)pyrazin-2-amine
CID 103341800
4-(3-cyclobutylphenyl)-N-ethyl-6-methylpyrimidin-2-amine
CID 114606872
2-N-(2-cyclobutylethyl)-6-N-propylpyrazine-2,6-diamine
CID 113479503
6-(4-cyclobutylphenyl)-N-propylpyrimidin-4-amine
CID 116506983
N-[(3-cyclobutylphenyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 114602740
N-benzyl-6-(3-methylphenyl)pyrazin-2-amine
CID 140905455
2-N-[(2-methylcyclopentyl)methyl]-6-N-propylpyrazine-2,6-diamine
CID 107421236
3-(3-cyclobutylphenyl)-N-propylcyclohexan-1-amine
CID 114606245
6-(2,3-dihydro-1-benzofuran-7-yl)-N-propylpyrazin-2-amine
CID 114747256
4-(4-cyclobutylphenyl)-6-methyl-N-propylpyrimidin-2-amine
CID 116506929

Frequently Asked Questions

What is the IUPAC name of 6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine?
The IUPAC name of 6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine (CID 114606962) is 6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine.
What is the SMILES notation for 6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine?
The canonical SMILES for 6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine is CCCNc1cncc(-c2cccc(C3CCC3)c2)n1.
What is the InChIKey of 6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine?
The InChIKey is VCEOTCAYZAZTCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3/c1-2-9-19-17-12-18-11-16(20-17)15-8-4-7-14(10-15)13-5-3-6-13/h4,7-8,10-13H,2-3,5-6,9H2,1H3,(H,19,20).
What are the key properties of 6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine?
6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine has a molecular weight of 267.38 g/mol, XLogP of 4.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-cyclobutylphenyl)-N-propylpyrazin-2-amine is sourced from PubChem (CID 114606962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).