ethane;N-pyrazin-2-ylpyrimidin-4-amine

C10H13N5 — CID 145071809

IUPACethane;N-pyrazin-2-ylpyrimidin-4-amine
SMILESCC.c1cc(Nc2cnccn2)ncn1
InChIInChI=1S/C8H7N5.C2H6/c1-2-10-6-12-7(1)13-8-5-9-3-4-11-8;1-2/h1-6H,(H,10,11,12,13);1-2H3
InChIKeyZJHHJMBGDIBSEP-UHFFFAOYSA-N
MW203.25 g/mol
LogP2.04
Rot. Bonds2

About ethane;N-pyrazin-2-ylpyrimidin-4-amine

ethane;N-pyrazin-2-ylpyrimidin-4-amine (PubChem CID 145071809) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is ethane;N-pyrazin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Nameethane;N-pyrazin-2-ylpyrimidin-4-amine
PubChem CID145071809
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Nameethane;N-pyrazin-2-ylpyrimidin-4-amine
SMILESCC.c1cc(Nc2cnccn2)ncn1
InChIInChI=1S/C8H7N5.C2H6/c1-2-10-6-12-7(1)13-8-5-9-3-4-11-8;1-2/h1-6H,(H,10,11,12,13);1-2H3
InChIKeyZJHHJMBGDIBSEP-UHFFFAOYSA-N
XLogP2.04
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of ethane;N-pyrazin-2-ylpyrimidin-4-amine?
The IUPAC name of ethane;N-pyrazin-2-ylpyrimidin-4-amine (CID 145071809) is ethane;N-pyrazin-2-ylpyrimidin-4-amine.
What is the SMILES notation for ethane;N-pyrazin-2-ylpyrimidin-4-amine?
The canonical SMILES for ethane;N-pyrazin-2-ylpyrimidin-4-amine is CC.c1cc(Nc2cnccn2)ncn1.
What is the InChIKey of ethane;N-pyrazin-2-ylpyrimidin-4-amine?
The InChIKey is ZJHHJMBGDIBSEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N5.C2H6/c1-2-10-6-12-7(1)13-8-5-9-3-4-11-8;1-2/h1-6H,(H,10,11,12,13);1-2H3.
What are the key properties of ethane;N-pyrazin-2-ylpyrimidin-4-amine?
ethane;N-pyrazin-2-ylpyrimidin-4-amine has a molecular weight of 203.25 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-pyrazin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 145071809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).