4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine

C10H13N5O — CID 3043537

IUPAC4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine
SMILESc1cnc2[nH]c(CN3CCOCC3)nc2n1
InChIInChI=1S/C10H13N5O/c1-2-12-10-9(11-1)13-8(14-10)7-15-3-5-16-6-4-15/h1-2H,3-7H2,(H,11,12,13,14)
InChIKeyCLRHLXOEUKQYBI-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.19
Rot. Bonds2

About 4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine

4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine (PubChem CID 3043537) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine.

Molecular Properties

Compound Name4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine
PubChem CID3043537
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine
SMILESc1cnc2[nH]c(CN3CCOCC3)nc2n1
InChIInChI=1S/C10H13N5O/c1-2-12-10-9(11-1)13-8(14-10)7-15-3-5-16-6-4-15/h1-2H,3-7H2,(H,11,12,13,14)
InChIKeyCLRHLXOEUKQYBI-UHFFFAOYSA-N
XLogP0.19
TPSA66.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine?
The IUPAC name of 4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine (CID 3043537) is 4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine.
What is the SMILES notation for 4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine?
The canonical SMILES for 4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine is c1cnc2[nH]c(CN3CCOCC3)nc2n1.
What is the InChIKey of 4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine?
The InChIKey is CLRHLXOEUKQYBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-2-12-10-9(11-1)13-8(14-10)7-15-3-5-16-6-4-15/h1-2H,3-7H2,(H,11,12,13,14).
What are the key properties of 4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine?
4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine has a molecular weight of 219.25 g/mol, XLogP of 0.19, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-imidazo[4,5-b]pyrazin-2-ylmethyl)morpholine is sourced from PubChem (CID 3043537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).