6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine

C14H21N5O — CID 80815215

IUPAC6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCNc1cn2ccnc2c(NCC2CCCCO2)n1
InChIInChI=1S/C14H21N5O/c1-2-15-12-10-19-7-6-16-14(19)13(18-12)17-9-11-5-3-4-8-20-11/h6-7,10-11,15H,2-5,8-9H2,1H3,(H,17,18)
InChIKeyFZAMNCLRXNSQFF-UHFFFAOYSA-N
MW275.36 g/mol
LogP2.14
Rot. Bonds5

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

6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80815215) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80815215
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCNc1cn2ccnc2c(NCC2CCCCO2)n1
InChIInChI=1S/C14H21N5O/c1-2-15-12-10-19-7-6-16-14(19)13(18-12)17-9-11-5-3-4-8-20-11/h6-7,10-11,15H,2-5,8-9H2,1H3,(H,17,18)
InChIKeyFZAMNCLRXNSQFF-UHFFFAOYSA-N
XLogP2.14
TPSA63.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine (CID 80815215) is 6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine is CCNc1cn2ccnc2c(NCC2CCCCO2)n1.
What is the InChIKey of 6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is FZAMNCLRXNSQFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-2-15-12-10-19-7-6-16-14(19)13(18-12)17-9-11-5-3-4-8-20-11/h6-7,10-11,15H,2-5,8-9H2,1H3,(H,17,18).
What are the key properties of 6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 275.36 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-8-N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80815215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).