3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide

C12H18N4O2 — CID 110268033

IUPAC3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide
SMILESCN1CCOC(c2cncc(CCC(N)=O)n2)C1
InChIInChI=1S/C12H18N4O2/c1-16-4-5-18-11(8-16)10-7-14-6-9(15-10)2-3-12(13)17/h6-7,11H,2-5,8H2,1H3,(H2,13,17)
InChIKeyPWWOIFMQZNCYPM-UHFFFAOYSA-N
MW250.30 g/mol
LogP-0.10
Rot. Bonds4

About 3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide

3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide (PubChem CID 110268033) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide.

Molecular Properties

Compound Name3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide
PubChem CID110268033
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide
SMILESCN1CCOC(c2cncc(CCC(N)=O)n2)C1
InChIInChI=1S/C12H18N4O2/c1-16-4-5-18-11(8-16)10-7-14-6-9(15-10)2-3-12(13)17/h6-7,11H,2-5,8H2,1H3,(H2,13,17)
InChIKeyPWWOIFMQZNCYPM-UHFFFAOYSA-N
XLogP-0.10
TPSA81.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide?
The IUPAC name of 3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide (CID 110268033) is 3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide.
What is the SMILES notation for 3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide?
The canonical SMILES for 3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide is CN1CCOC(c2cncc(CCC(N)=O)n2)C1.
What is the InChIKey of 3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide?
The InChIKey is PWWOIFMQZNCYPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-16-4-5-18-11(8-16)10-7-14-6-9(15-10)2-3-12(13)17/h6-7,11H,2-5,8H2,1H3,(H2,13,17).
What are the key properties of 3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide?
3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide has a molecular weight of 250.30 g/mol, XLogP of -0.10, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-(4-methylmorpholin-2-yl)pyrazin-2-yl]propanamide is sourced from PubChem (CID 110268033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).