N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine

C11H20N4 — CID 107378992

IUPACN,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
SMILESCC(C)CNCc1cnc(N(C)C)cn1
InChIInChI=1S/C11H20N4/c1-9(2)5-12-6-10-7-14-11(8-13-10)15(3)4/h7-9,12H,5-6H2,1-4H3
InChIKeyKWZVUSRLKGQDKN-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.29
Rot. Bonds5

About N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine

N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine (PubChem CID 107378992) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
PubChem CID107378992
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC NameN,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
SMILESCC(C)CNCc1cnc(N(C)C)cn1
InChIInChI=1S/C11H20N4/c1-9(2)5-12-6-10-7-14-11(8-13-10)15(3)4/h7-9,12H,5-6H2,1-4H3
InChIKeyKWZVUSRLKGQDKN-UHFFFAOYSA-N
XLogP1.29
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine?
The IUPAC name of N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine (CID 107378992) is N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine.
What is the SMILES notation for N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine?
The canonical SMILES for N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine is CC(C)CNCc1cnc(N(C)C)cn1.
What is the InChIKey of N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine?
The InChIKey is KWZVUSRLKGQDKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-9(2)5-12-6-10-7-14-11(8-13-10)15(3)4/h7-9,12H,5-6H2,1-4H3.
What are the key properties of N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine?
N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine has a molecular weight of 208.31 g/mol, XLogP of 1.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine is sourced from PubChem (CID 107378992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).