N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine

C12H22N4 — CID 107379708

IUPACN-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine
SMILESCNCc1cnc(N(C)CCC(C)C)cn1
InChIInChI=1S/C12H22N4/c1-10(2)5-6-16(4)12-9-14-11(7-13-3)8-15-12/h8-10,13H,5-7H2,1-4H3
InChIKeyMJOPXQFFNUWUQW-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.68
Rot. Bonds6

About N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine

N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine (PubChem CID 107379708) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine
PubChem CID107379708
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC NameN-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine
SMILESCNCc1cnc(N(C)CCC(C)C)cn1
InChIInChI=1S/C12H22N4/c1-10(2)5-6-16(4)12-9-14-11(7-13-3)8-15-12/h8-10,13H,5-7H2,1-4H3
InChIKeyMJOPXQFFNUWUQW-UHFFFAOYSA-N
XLogP1.68
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(methylaminomethyl)-N,N-bis(3-methylbutyl)pyrazin-2-amine
CID 107871217
6-ethyl-N-methyl-4-(methylaminomethyl)-N-(3-methylbutyl)pyridin-2-amine
CID 113381387
5-(methylaminomethyl)-N-propan-2-yl-N-propylpyrazin-2-amine
CID 107379107
2-N,4-N-dimethyl-4-N-(3-methylbutyl)pyrimidine-2,4-diamine
CID 80795078
N-cyclopentyl-5-(methylaminomethyl)-N-(2-methylpropyl)pyrazin-2-amine
CID 107380576
N-methyl-5-(methylaminomethyl)-N-(4-methylsulfanylbutan-2-yl)pyrazin-2-amine
CID 107380932
6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine
CID 66451243
N-[(4-bromophenyl)methyl]-N-methyl-5-(methylaminomethyl)pyrazin-2-amine
CID 107379910
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrazin-2-amine
CID 107380992
N-methyl-5-(methylaminomethyl)-N-[(6-methyl-2-pyridinyl)methyl]pyrazin-2-amine
CID 107380595
5-(methylaminomethyl)-N,N-bis(3-methylbutyl)pyridin-2-amine
CID 107870528
N-[(2-chlorophenyl)methyl]-N-methyl-5-(methylaminomethyl)pyrazin-2-amine
CID 107379915

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine?
The IUPAC name of N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine (CID 107379708) is N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine.
What is the SMILES notation for N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine?
The canonical SMILES for N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine is CNCc1cnc(N(C)CCC(C)C)cn1.
What is the InChIKey of N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine?
The InChIKey is MJOPXQFFNUWUQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-10(2)5-6-16(4)12-9-14-11(7-13-3)8-15-12/h8-10,13H,5-7H2,1-4H3.
What are the key properties of N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine?
N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine has a molecular weight of 222.34 g/mol, XLogP of 1.68, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine is sourced from PubChem (CID 107379708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).