4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide

C12H17N5O2 — CID 83106114

IUPAC4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide
SMILESNC(=O)C1COCCN1c1cc(N)nc(C2CC2)n1
InChIInChI=1S/C12H17N5O2/c13-9-5-10(16-12(15-9)7-1-2-7)17-3-4-19-6-8(17)11(14)18/h5,7-8H,1-4,6H2,(H2,14,18)(H2,13,15,16)
InChIKeyCGZJDOSZMYKKES-UHFFFAOYSA-N
MW263.30 g/mol
LogP-0.37
Rot. Bonds3

About 4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide

4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide (PubChem CID 83106114) has the molecular formula C12H17N5O2 and a molecular weight of 263.30 g/mol. Its IUPAC name is 4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide.

Molecular Properties

Compound Name4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide
PubChem CID83106114
Molecular FormulaC12H17N5O2
Molecular Weight263.30 g/mol
Exact Mass263.14
IUPAC Name4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide
SMILESNC(=O)C1COCCN1c1cc(N)nc(C2CC2)n1
InChIInChI=1S/C12H17N5O2/c13-9-5-10(16-12(15-9)7-1-2-7)17-3-4-19-6-8(17)11(14)18/h5,7-8H,1-4,6H2,(H2,14,18)(H2,13,15,16)
InChIKeyCGZJDOSZMYKKES-UHFFFAOYSA-N
XLogP-0.37
TPSA107.36 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-(6-amino-2-cyclopropylpyrimidin-4-yl)pyrrolidine-2-carboxamide
CID 80956973
6-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-2-cyclopropylpyrimidin-4-amine
CID 80961930
4-(6-chloropyrazin-2-yl)morpholine-3-carboxamide
CID 83095551
2-cyclopropyl-6-(2-propan-2-ylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80959966
4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide
CID 75483897
4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide
CID 83106116
4-(6-hydrazinyl-2-methylsulfanylpyrimidin-4-yl)morpholine-3-carboxamide
CID 83107029
[4-(6-amino-2-cyclopropylpyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol
CID 81218063
4-(6-hydrazinylpyrazin-2-yl)morpholine-3-carboxamide
CID 83106538
6-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-cyclopropylpyrimidin-4-amine
CID 102729187
4-(6-amino-1,3-benzoxazol-2-yl)morpholine-3-carboxamide
CID 83094750
4-(6-methyl-5-nitro-2-pyridinyl)morpholine-3-carboxamide
CID 133452657

Frequently Asked Questions

What is the IUPAC name of 4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide?
The IUPAC name of 4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide (CID 83106114) is 4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide.
What is the SMILES notation for 4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide?
The canonical SMILES for 4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide is NC(=O)C1COCCN1c1cc(N)nc(C2CC2)n1.
What is the InChIKey of 4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide?
The InChIKey is CGZJDOSZMYKKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O2/c13-9-5-10(16-12(15-9)7-1-2-7)17-3-4-19-6-8(17)11(14)18/h5,7-8H,1-4,6H2,(H2,14,18)(H2,13,15,16).
What are the key properties of 4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide?
4-(6-amino-2-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide has a molecular weight of 263.30 g/mol, XLogP of -0.37, 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-cyclopropylpyrimidin-4-yl)morpholine-3-carboxamide is sourced from PubChem (CID 83106114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).