4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide

C14H23N5O2 — CID 83105267

IUPAC4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide
SMILESCc1nc(N)c(C)c(N2CCOCC2C(=O)NC(C)C)n1
InChIInChI=1S/C14H23N5O2/c1-8(2)16-14(20)11-7-21-6-5-19(11)13-9(3)12(15)17-10(4)18-13/h8,11H,5-7H2,1-4H3,(H,16,20)(H2,15,17,18)
InChIKeyYKHXFKHSQODUNG-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.41
Rot. Bonds3

About 4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide

4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide (PubChem CID 83105267) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide
PubChem CID83105267
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC Name4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide
SMILESCc1nc(N)c(C)c(N2CCOCC2C(=O)NC(C)C)n1
InChIInChI=1S/C14H23N5O2/c1-8(2)16-14(20)11-7-21-6-5-19(11)13-9(3)12(15)17-10(4)18-13/h8,11H,5-7H2,1-4H3,(H,16,20)(H2,15,17,18)
InChIKeyYKHXFKHSQODUNG-UHFFFAOYSA-N
XLogP0.41
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-(3-amino-6-methyl-2-pyridinyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83106140
4-(2-amino-5-methylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83105110
4-(6-chloro-2-methylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83103410
4-(5-aminopyrimidin-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83106634
4-(3-amino-5-methylphenyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 115980875
4-(2-amino-5-methylphenyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83107053
4-(3-amino-5-bromo-4-pyridinyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 103518402
4-(4-amino-1,2,5-oxadiazole-3-carbonyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83097666
4-(6-hydrazinyl-2-pyridinyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83105801
4-[5-bromo-2-(methylamino)pyrimidin-4-yl]-N-propan-2-ylmorpholine-3-carboxamide
CID 83104655
3-N-propan-2-ylmorpholine-3,4-dicarboxamide
CID 83106391
4-(3-amino-5-fluorophenyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83106635

Frequently Asked Questions

What is the IUPAC name of 4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide?
The IUPAC name of 4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide (CID 83105267) is 4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide.
What is the SMILES notation for 4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide?
The canonical SMILES for 4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide is Cc1nc(N)c(C)c(N2CCOCC2C(=O)NC(C)C)n1.
What is the InChIKey of 4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide?
The InChIKey is YKHXFKHSQODUNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2/c1-8(2)16-14(20)11-7-21-6-5-19(11)13-9(3)12(15)17-10(4)18-13/h8,11H,5-7H2,1-4H3,(H,16,20)(H2,15,17,18).
What are the key properties of 4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide?
4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-amino-2,5-dimethylpyrimidin-4-yl)-N-propan-2-ylmorpholine-3-carboxamide is sourced from PubChem (CID 83105267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).