1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide

C15H24N4O2 — CID 114827966

IUPAC1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
SMILESCCOC1CC(N)(C(=O)Nc2nc(C)cc(C)n2)C1(C)C
InChIInChI=1S/C15H24N4O2/c1-6-21-11-8-15(16,14(11,4)5)12(20)19-13-17-9(2)7-10(3)18-13/h7,11H,6,8,16H2,1-5H3,(H,17,18,19,20)
InChIKeyQZNPWSMTGFQTGE-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.56
Rot. Bonds4

About 1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide

1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide (PubChem CID 114827966) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
PubChem CID114827966
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
SMILESCCOC1CC(N)(C(=O)Nc2nc(C)cc(C)n2)C1(C)C
InChIInChI=1S/C15H24N4O2/c1-6-21-11-8-15(16,14(11,4)5)12(20)19-13-17-9(2)7-10(3)18-13/h7,11H,6,8,16H2,1-5H3,(H,17,18,19,20)
InChIKeyQZNPWSMTGFQTGE-UHFFFAOYSA-N
XLogP1.56
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-amino-3-ethoxy-N-(4-methoxyphenyl)-2,2-dimethylcyclobutane-1-carboxamide
CID 114827748
1-amino-3-ethoxy-2,2-dimethyl-N-(2-methylphenyl)cyclobutane-1-carboxamide
CID 114827931
1-amino-N-(5-chloro-2-methylphenyl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
CID 114827953
1-amino-N-(4-chloro-2-methylphenyl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
CID 114827956
1-amino-3-ethoxy-2,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]cyclobutane-1-carboxamide
CID 114829359
1-amino-3-ethoxy-N-hydroxy-2,2-dimethylcyclobutane-1-carboxamide
CID 114829312
1-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
CID 114829916
1-amino-3-ethoxy-N-(2-ethylphenyl)-2,2-dimethylcyclobutane-1-carboxamide
CID 114827880
1-amino-3-ethoxy-N-ethyl-2,2-dimethylcyclobutane-1-carboxamide
CID 114827765
1-amino-3-ethoxy-2,2-dimethyl-N-(2-methyl-1,2,4-triazol-3-yl)cyclobutane-1-carboxamide
CID 114829707
1-amino-3-ethoxy-N-(6-fluoro-3-pyridinyl)-2,2-dimethylcyclobutane-1-carboxamide
CID 105055820
1-amino-3-ethoxy-2,2-dimethyl-N-(2,2,3,3-tetramethylcyclopropyl)cyclobutane-1-carboxamide
CID 114829539

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide?
The IUPAC name of 1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide (CID 114827966) is 1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide?
The canonical SMILES for 1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide is CCOC1CC(N)(C(=O)Nc2nc(C)cc(C)n2)C1(C)C.
What is the InChIKey of 1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide?
The InChIKey is QZNPWSMTGFQTGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-6-21-11-8-15(16,14(11,4)5)12(20)19-13-17-9(2)7-10(3)18-13/h7,11H,6,8,16H2,1-5H3,(H,17,18,19,20).
What are the key properties of 1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide?
1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.56, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide is sourced from PubChem (CID 114827966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).