2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine

C16H13N5S — CID 46952213

IUPAC2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
SMILESc1cncc(-c2nc3cnccn3c2NCc2cccs2)c1
InChIInChI=1S/C16H13N5S/c1-3-12(9-17-5-1)15-16(19-10-13-4-2-8-22-13)21-7-6-18-11-14(21)20-15/h1-9,11,19H,10H2
InChIKeyDWQQBBFWGZVFFD-UHFFFAOYSA-N
MW307.38 g/mol
LogP3.46
Rot. Bonds4

About 2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine

2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine (PubChem CID 46952213) has the molecular formula C16H13N5S and a molecular weight of 307.38 g/mol. Its IUPAC name is 2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine.

Molecular Properties

Compound Name2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
PubChem CID46952213
Molecular FormulaC16H13N5S
Molecular Weight307.38 g/mol
Exact Mass307.09
IUPAC Name2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
SMILESc1cncc(-c2nc3cnccn3c2NCc2cccs2)c1
InChIInChI=1S/C16H13N5S/c1-3-12(9-17-5-1)15-16(19-10-13-4-2-8-22-13)21-7-6-18-11-14(21)20-15/h1-9,11,19H,10H2
InChIKeyDWQQBBFWGZVFFD-UHFFFAOYSA-N
XLogP3.46
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.38
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
The IUPAC name of 2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine (CID 46952213) is 2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine.
What is the SMILES notation for 2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
The canonical SMILES for 2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine is c1cncc(-c2nc3cnccn3c2NCc2cccs2)c1.
What is the InChIKey of 2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
The InChIKey is DWQQBBFWGZVFFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N5S/c1-3-12(9-17-5-1)15-16(19-10-13-4-2-8-22-13)21-7-6-18-11-14(21)20-15/h1-9,11,19H,10H2.
What are the key properties of 2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine has a molecular weight of 307.38 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine is sourced from PubChem (CID 46952213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).