5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane

C15H28N4O2 — CID 170574565

IUPAC5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane
SMILESCC.CC.CCc1ncc(N)c(C(=O)NC2CCOC2)n1
InChIInChI=1S/C11H16N4O2.2C2H6/c1-2-9-13-5-8(12)10(15-9)11(16)14-7-3-4-17-6-7;2*1-2/h5,7H,2-4,6,12H2,1H3,(H,14,16);2*1-2H3
InChIKeyUYTIALLZPLJIER-UHFFFAOYSA-N
MW296.42 g/mol
LogP2.19
Rot. Bonds3

About 5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane

5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane (PubChem CID 170574565) has the molecular formula C15H28N4O2 and a molecular weight of 296.42 g/mol. Its IUPAC name is 5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane.

Molecular Properties

Compound Name5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane
PubChem CID170574565
Molecular FormulaC15H28N4O2
Molecular Weight296.42 g/mol
Exact Mass296.22
IUPAC Name5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane
SMILESCC.CC.CCc1ncc(N)c(C(=O)NC2CCOC2)n1
InChIInChI=1S/C11H16N4O2.2C2H6/c1-2-9-13-5-8(12)10(15-9)11(16)14-7-3-4-17-6-7;2*1-2/h5,7H,2-4,6,12H2,1H3,(H,14,16);2*1-2H3
InChIKeyUYTIALLZPLJIER-UHFFFAOYSA-N
XLogP2.19
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 62161178
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CID 62162034
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CID 62171561
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CID 62171737
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CID 62171738
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CID 62179328
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CID 62179329
CID 62179329

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane?
The IUPAC name of 5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane (CID 170574565) is 5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane.
What is the SMILES notation for 5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane?
The canonical SMILES for 5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane is CC.CC.CCc1ncc(N)c(C(=O)NC2CCOC2)n1.
What is the InChIKey of 5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane?
The InChIKey is UYTIALLZPLJIER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2.2C2H6/c1-2-9-13-5-8(12)10(15-9)11(16)14-7-3-4-17-6-7;2*1-2/h5,7H,2-4,6,12H2,1H3,(H,14,16);2*1-2H3.
What are the key properties of 5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane?
5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane has a molecular weight of 296.42 g/mol, XLogP of 2.19, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-ethyl-N-(oxolan-3-yl)pyrimidine-4-carboxamide;ethane is sourced from PubChem (CID 170574565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).