N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide

C15H24N4O — CID 50979838

IUPACN-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide
SMILESCCc1cnc(C)nc1N1CCC(N(CC)C(C)=O)C1
InChIInChI=1S/C15H24N4O/c1-5-13-9-16-11(3)17-15(13)18-8-7-14(10-18)19(6-2)12(4)20/h9,14H,5-8,10H2,1-4H3
InChIKeyXAZPSEYYVDOFAN-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.79
Rot. Bonds4

About N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide

N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide (PubChem CID 50979838) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide.

Molecular Properties

Compound NameN-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide
PubChem CID50979838
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide
SMILESCCc1cnc(C)nc1N1CCC(N(CC)C(C)=O)C1
InChIInChI=1S/C15H24N4O/c1-5-13-9-16-11(3)17-15(13)18-8-7-14(10-18)19(6-2)12(4)20/h9,14H,5-8,10H2,1-4H3
InChIKeyXAZPSEYYVDOFAN-UHFFFAOYSA-N
XLogP1.79
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide?
The IUPAC name of N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide (CID 50979838) is N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide.
What is the SMILES notation for N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide?
The canonical SMILES for N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide is CCc1cnc(C)nc1N1CCC(N(CC)C(C)=O)C1.
What is the InChIKey of N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide?
The InChIKey is XAZPSEYYVDOFAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-5-13-9-16-11(3)17-15(13)18-8-7-14(10-18)19(6-2)12(4)20/h9,14H,5-8,10H2,1-4H3.
What are the key properties of N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide?
N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide has a molecular weight of 276.38 g/mol, XLogP of 1.79, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[1-(5-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]acetamide is sourced from PubChem (CID 50979838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).