(3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine

C7H13N3 — CID 67991660

IUPAC(3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine
SMILESC[C@@H]1N=CC=NC1N(C)C
InChIInChI=1S/C7H13N3/c1-6-7(10(2)3)9-5-4-8-6/h4-7H,1-3H3/t6-,7?/m0/s1
InChIKeyZYGWSDDUKLDUOO-PKPIPKONSA-N
MW139.20 g/mol
LogP0.42
Rot. Bonds1

About (3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine

(3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine (PubChem CID 67991660) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is (3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine.

Molecular Properties

Compound Name(3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine
PubChem CID67991660
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name(3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine
SMILESC[C@@H]1N=CC=NC1N(C)C
InChIInChI=1S/C7H13N3/c1-6-7(10(2)3)9-5-4-8-6/h4-7H,1-3H3/t6-,7?/m0/s1
InChIKeyZYGWSDDUKLDUOO-PKPIPKONSA-N
XLogP0.42
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine?
The IUPAC name of (3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine (CID 67991660) is (3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine.
What is the SMILES notation for (3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine?
The canonical SMILES for (3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine is C[C@@H]1N=CC=NC1N(C)C.
What is the InChIKey of (3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine?
The InChIKey is ZYGWSDDUKLDUOO-PKPIPKONSA-N. The full InChI is InChI=1S/C7H13N3/c1-6-7(10(2)3)9-5-4-8-6/h4-7H,1-3H3/t6-,7?/m0/s1.
What are the key properties of (3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine?
(3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine has a molecular weight of 139.20 g/mol, XLogP of 0.42, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N,N,3-trimethyl-2,3-dihydropyrazin-2-amine is sourced from PubChem (CID 67991660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).