(2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone

C9H12N4O2 — CID 117212768

IUPAC(2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone
SMILESNc1nccc(C(=O)N2CCOCC2)n1
InChIInChI=1S/C9H12N4O2/c10-9-11-2-1-7(12-9)8(14)13-3-5-15-6-4-13/h1-2H,3-6H2,(H2,10,11,12)
InChIKeyLNNXEVNNPJGFAR-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.47
Rot. Bonds1

About (2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone

(2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone (PubChem CID 117212768) has the molecular formula C9H12N4O2 and a molecular weight of 208.22 g/mol. Its IUPAC name is (2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone
PubChem CID117212768
Molecular FormulaC9H12N4O2
Molecular Weight208.22 g/mol
Exact Mass208.10
IUPAC Name(2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone
SMILESNc1nccc(C(=O)N2CCOCC2)n1
InChIInChI=1S/C9H12N4O2/c10-9-11-2-1-7(12-9)8(14)13-3-5-15-6-4-13/h1-2H,3-6H2,(H2,10,11,12)
InChIKeyLNNXEVNNPJGFAR-UHFFFAOYSA-N
XLogP-0.47
TPSA81.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(N-methylanilino)pyrimidin-4-yl]-morpholin-4-ylmethanone
CID 109300595
[2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone
CID 109298958
[6-(morpholine-4-carbonyl)-2-pyridinyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 109096023
[2-[4-(morpholine-4-carbonyl)-2-pyridinyl]-4-pyridinyl]-morpholin-4-ylmethanone
CID 171623322
[2-(2-methoxyethylamino)pyrimidin-4-yl]-morpholin-4-ylmethanone
CID 109299603
[2-[benzyl(methyl)amino]pyrimidin-4-yl]-morpholin-4-ylmethanone
CID 109300530
[2-(2-bromoanilino)pyrimidin-4-yl]-morpholin-4-ylmethanone
CID 109300664
morpholin-4-yl-[2-(4-piperidin-1-ylanilino)pyrimidin-4-yl]methanone
CID 109300656
morpholin-4-yl-(6-morpholin-4-yl-2-pyridinyl)methanone
CID 84575028
N,N-diethyl-6-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109096024
[2-(3-bromo-4-methylanilino)pyrimidin-4-yl]-morpholin-4-ylmethanone
CID 109300629
1-[3-[[4-(morpholine-4-carbonyl)pyrimidin-2-yl]amino]phenyl]ethanone
CID 109300644

Frequently Asked Questions

What is the IUPAC name of (2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone?
The IUPAC name of (2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone (CID 117212768) is (2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone is Nc1nccc(C(=O)N2CCOCC2)n1.
What is the InChIKey of (2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone?
The InChIKey is LNNXEVNNPJGFAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O2/c10-9-11-2-1-7(12-9)8(14)13-3-5-15-6-4-13/h1-2H,3-6H2,(H2,10,11,12).
What are the key properties of (2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone?
(2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone has a molecular weight of 208.22 g/mol, XLogP of -0.47, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 117212768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).