N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine

C11H17N3 — CID 131070929

IUPACN-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine
SMILESCc1cncc(NCC2CC2(C)C)n1
InChIInChI=1S/C11H17N3/c1-8-5-12-7-10(14-8)13-6-9-4-11(9,2)3/h5,7,9H,4,6H2,1-3H3,(H,13,14)
InChIKeyRCKGDWDFCDVNGO-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.24
Rot. Bonds3

About N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine

N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine (PubChem CID 131070929) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine.

Molecular Properties

Compound NameN-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine
PubChem CID131070929
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC NameN-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine
SMILESCc1cncc(NCC2CC2(C)C)n1
InChIInChI=1S/C11H17N3/c1-8-5-12-7-10(14-8)13-6-9-4-11(9,2)3/h5,7,9H,4,6H2,1-3H3,(H,13,14)
InChIKeyRCKGDWDFCDVNGO-UHFFFAOYSA-N
XLogP2.24
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine?
The IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine (CID 131070929) is N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine.
What is the SMILES notation for N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine?
The canonical SMILES for N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine is Cc1cncc(NCC2CC2(C)C)n1.
What is the InChIKey of N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine?
The InChIKey is RCKGDWDFCDVNGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-8-5-12-7-10(14-8)13-6-9-4-11(9,2)3/h5,7,9H,4,6H2,1-3H3,(H,13,14).
What are the key properties of N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine?
N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine has a molecular weight of 191.28 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2-dimethylcyclopropyl)methyl]-6-methylpyrazin-2-amine is sourced from PubChem (CID 131070929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).