8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine

C12H17N5 — CID 113476564

IUPAC8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCC(CNc1nc(N)cn2ccnc12)C1CC1
InChIInChI=1S/C12H17N5/c1-8(9-2-3-9)6-15-11-12-14-4-5-17(12)7-10(13)16-11/h4-5,7-9H,2-3,6,13H2,1H3,(H,15,16)
InChIKeyYEQCKHPESWRGQR-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.77
Rot. Bonds4

About 8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine

8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 113476564) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is 8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID113476564
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC Name8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCC(CNc1nc(N)cn2ccnc12)C1CC1
InChIInChI=1S/C12H17N5/c1-8(9-2-3-9)6-15-11-12-14-4-5-17(12)7-10(13)16-11/h4-5,7-9H,2-3,6,13H2,1H3,(H,15,16)
InChIKeyYEQCKHPESWRGQR-UHFFFAOYSA-N
XLogP1.77
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine (CID 113476564) is 8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine is CC(CNc1nc(N)cn2ccnc12)C1CC1.
What is the InChIKey of 8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is YEQCKHPESWRGQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c1-8(9-2-3-9)6-15-11-12-14-4-5-17(12)7-10(13)16-11/h4-5,7-9H,2-3,6,13H2,1H3,(H,15,16).
What are the key properties of 8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine?
8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 231.30 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 113476564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).