N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine

C11H12N4O — CID 60710836

IUPACN-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine
SMILESCOc1ccc(CNc2cnccn2)cn1
InChIInChI=1S/C11H12N4O/c1-16-11-3-2-9(7-15-11)6-14-10-8-12-4-5-13-10/h2-5,7-8H,6H2,1H3,(H,13,14)
InChIKeyQXHLGCQPRBXVBB-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.49
Rot. Bonds4

About N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine

N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine (PubChem CID 60710836) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine
PubChem CID60710836
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC NameN-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine
SMILESCOc1ccc(CNc2cnccn2)cn1
InChIInChI=1S/C11H12N4O/c1-16-11-3-2-9(7-15-11)6-14-10-8-12-4-5-13-10/h2-5,7-8H,6H2,1H3,(H,13,14)
InChIKeyQXHLGCQPRBXVBB-UHFFFAOYSA-N
XLogP1.49
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine?
The IUPAC name of N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine (CID 60710836) is N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine.
What is the SMILES notation for N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine?
The canonical SMILES for N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine is COc1ccc(CNc2cnccn2)cn1.
What is the InChIKey of N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine?
The InChIKey is QXHLGCQPRBXVBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c1-16-11-3-2-9(7-15-11)6-14-10-8-12-4-5-13-10/h2-5,7-8H,6H2,1H3,(H,13,14).
What are the key properties of N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine?
N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine has a molecular weight of 216.24 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine is sourced from PubChem (CID 60710836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).