N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide

C11H19N5O — CID 106918612

IUPACN,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide
SMILESCNC(=O)C(C)CN(C)c1cncc(NC)n1
InChIInChI=1S/C11H19N5O/c1-8(11(17)13-3)7-16(4)10-6-14-5-9(12-2)15-10/h5-6,8H,7H2,1-4H3,(H,12,15)(H,13,17)
InChIKeyJINCQUKLXXBYHQ-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.34
Rot. Bonds5

About N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide

N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide (PubChem CID 106918612) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide.

Molecular Properties

Compound NameN,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide
PubChem CID106918612
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC NameN,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide
SMILESCNC(=O)C(C)CN(C)c1cncc(NC)n1
InChIInChI=1S/C11H19N5O/c1-8(11(17)13-3)7-16(4)10-6-14-5-9(12-2)15-10/h5-6,8H,7H2,1-4H3,(H,12,15)(H,13,17)
InChIKeyJINCQUKLXXBYHQ-UHFFFAOYSA-N
XLogP0.34
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide?
The IUPAC name of N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide (CID 106918612) is N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide.
What is the SMILES notation for N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide?
The canonical SMILES for N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide is CNC(=O)C(C)CN(C)c1cncc(NC)n1.
What is the InChIKey of N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide?
The InChIKey is JINCQUKLXXBYHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-8(11(17)13-3)7-16(4)10-6-14-5-9(12-2)15-10/h5-6,8H,7H2,1-4H3,(H,12,15)(H,13,17).
What are the key properties of N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide?
N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide has a molecular weight of 237.31 g/mol, XLogP of 0.34, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-[methyl-[6-(methylamino)pyrazin-2-yl]amino]propanamide is sourced from PubChem (CID 106918612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).