N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine

C15H20N6 — CID 110095070

IUPACN-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
SMILESCNc1nccnc1CC1CCCN(c2cnccn2)C1
InChIInChI=1S/C15H20N6/c1-16-15-13(18-6-7-20-15)9-12-3-2-8-21(11-12)14-10-17-4-5-19-14/h4-7,10,12H,2-3,8-9,11H2,1H3,(H,16,20)
InChIKeyWWAWBZKUACYQCH-UHFFFAOYSA-N
MW284.37 g/mol
LogP1.77
Rot. Bonds4

About N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine

N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine (PubChem CID 110095070) has the molecular formula C15H20N6 and a molecular weight of 284.37 g/mol. Its IUPAC name is N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
PubChem CID110095070
Molecular FormulaC15H20N6
Molecular Weight284.37 g/mol
Exact Mass284.17
IUPAC NameN-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
SMILESCNc1nccnc1CC1CCCN(c2cnccn2)C1
InChIInChI=1S/C15H20N6/c1-16-15-13(18-6-7-20-15)9-12-3-2-8-21(11-12)14-10-17-4-5-19-14/h4-7,10,12H,2-3,8-9,11H2,1H3,(H,16,20)
InChIKeyWWAWBZKUACYQCH-UHFFFAOYSA-N
XLogP1.77
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
The IUPAC name of N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine (CID 110095070) is N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
The canonical SMILES for N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine is CNc1nccnc1CC1CCCN(c2cnccn2)C1.
What is the InChIKey of N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
The InChIKey is WWAWBZKUACYQCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6/c1-16-15-13(18-6-7-20-15)9-12-3-2-8-21(11-12)14-10-17-4-5-19-14/h4-7,10,12H,2-3,8-9,11H2,1H3,(H,16,20).
What are the key properties of N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine has a molecular weight of 284.37 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 110095070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).