1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine

C16H19N3 — CID 114602735

IUPAC1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
SMILESCNC(c1cnccn1)c1ccccc1C1CCC1
InChIInChI=1S/C16H19N3/c1-17-16(15-11-18-9-10-19-15)14-8-3-2-7-13(14)12-5-4-6-12/h2-3,7-12,16-17H,4-6H2,1H3
InChIKeyVIVXTLNLDKCLAC-UHFFFAOYSA-N
MW253.35 g/mol
LogP3.05
Rot. Bonds4

About 1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine

1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine (PubChem CID 114602735) has the molecular formula C16H19N3 and a molecular weight of 253.35 g/mol. Its IUPAC name is 1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine.

Molecular Properties

Compound Name1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
PubChem CID114602735
Molecular FormulaC16H19N3
Molecular Weight253.35 g/mol
Exact Mass253.16
IUPAC Name1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
SMILESCNC(c1cnccn1)c1ccccc1C1CCC1
InChIInChI=1S/C16H19N3/c1-17-16(15-11-18-9-10-19-15)14-8-3-2-7-13(14)12-5-4-6-12/h2-3,7-12,16-17H,4-6H2,1H3
InChIKeyVIVXTLNLDKCLAC-UHFFFAOYSA-N
XLogP3.05
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine
CID 114604437
1-(2-cyclobutylphenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
CID 105066142
1-(2-cyclobutylphenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine
CID 114604500
1-(2-cyclobutylphenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
CID 105188804
1-(2-cyclobutylphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
CID 105188892
N-methyl-1-naphthalen-1-yl-1-pyrazin-2-ylmethanamine
CID 62791384
1-(2-tert-butylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
CID 115860660
N-methyl-1,1-di(pyrazin-2-yl)methanamine
CID 63968599
1-(2,3-dimethylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
CID 55085229
1-(4-bromophenyl)-1-(2-cyclobutylphenyl)-N-methylmethanamine
CID 114602530
1-(2-bromo-3-methylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
CID 107984997
1-(3-bromo-2-methylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
CID 115860344

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine?
The IUPAC name of 1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine (CID 114602735) is 1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine.
What is the SMILES notation for 1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine?
The canonical SMILES for 1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine is CNC(c1cnccn1)c1ccccc1C1CCC1.
What is the InChIKey of 1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine?
The InChIKey is VIVXTLNLDKCLAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3/c1-17-16(15-11-18-9-10-19-15)14-8-3-2-7-13(14)12-5-4-6-12/h2-3,7-12,16-17H,4-6H2,1H3.
What are the key properties of 1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine?
1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine has a molecular weight of 253.35 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine is sourced from PubChem (CID 114602735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).