N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine

C13H22N4 — CID 66457612

IUPACN-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine
SMILESCCNCc1cncc(N(C)C(C)C2CC2)n1
InChIInChI=1S/C13H22N4/c1-4-14-7-12-8-15-9-13(16-12)17(3)10(2)11-5-6-11/h8-11,14H,4-7H2,1-3H3
InChIKeyMMEJSUUCTTWBAL-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.82
Rot. Bonds6

About N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine

N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine (PubChem CID 66457612) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine
PubChem CID66457612
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC NameN-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine
SMILESCCNCc1cncc(N(C)C(C)C2CC2)n1
InChIInChI=1S/C13H22N4/c1-4-14-7-12-8-15-9-13(16-12)17(3)10(2)11-5-6-11/h8-11,14H,4-7H2,1-3H3
InChIKeyMMEJSUUCTTWBAL-UHFFFAOYSA-N
XLogP1.82
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine?
The IUPAC name of N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine (CID 66457612) is N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine is CCNCc1cncc(N(C)C(C)C2CC2)n1.
What is the InChIKey of N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine?
The InChIKey is MMEJSUUCTTWBAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-4-14-7-12-8-15-9-13(16-12)17(3)10(2)11-5-6-11/h8-11,14H,4-7H2,1-3H3.
What are the key properties of N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine?
N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine has a molecular weight of 234.35 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine is sourced from PubChem (CID 66457612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).