4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one

C10H16N4O2 — CID 137008164

IUPAC4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one
SMILESCc1nc(N2CCOCC2CN)cc(=O)[nH]1
InChIInChI=1S/C10H16N4O2/c1-7-12-9(4-10(15)13-7)14-2-3-16-6-8(14)5-11/h4,8H,2-3,5-6,11H2,1H3,(H,12,13,15)
InChIKeyAOWLAKZFBQKOID-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.76
Rot. Bonds2

About 4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one

4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one (PubChem CID 137008164) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one
PubChem CID137008164
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one
SMILESCc1nc(N2CCOCC2CN)cc(=O)[nH]1
InChIInChI=1S/C10H16N4O2/c1-7-12-9(4-10(15)13-7)14-2-3-16-6-8(14)5-11/h4,8H,2-3,5-6,11H2,1H3,(H,12,13,15)
InChIKeyAOWLAKZFBQKOID-UHFFFAOYSA-N
XLogP-0.76
TPSA84.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one
CID 135592113
[4-(6-methoxypyrimidin-4-yl)morpholin-3-yl]methanamine
CID 83095664
4-[2-[(cyclopropylamino)methyl]pyrrolidin-1-yl]-2-methyl-1H-pyrimidin-6-one
CID 137007881
3-[1-(2-methyl-6-oxo-1H-pyrimidin-4-yl)piperidin-2-yl]propanoic acid
CID 136958739
N-[[4-(6-methoxy-2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]propan-2-amine
CID 83105220
[4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-3-yl]methanamine
CID 116972580
2-methyl-4-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]-1H-pyrimidin-6-one
CID 137007800
4-[3-[(cyclopropylamino)methyl]morpholin-4-yl]-1H-pyrimidin-6-one
CID 137008187
N-[[4-(6-methyl-2-pyridinyl)morpholin-3-yl]methyl]propan-2-amine
CID 83105217
4-(3-amino-3-cyclopropylazetidin-1-yl)-2-methyl-1H-pyrimidin-6-one
CID 137008576
2-methyl-4-[2-(methylaminomethyl)morpholin-4-yl]-1H-pyrimidin-6-one
CID 136978852
1-[4-(6-chloro-2-methylpyrimidin-4-yl)morpholin-3-yl]propan-2-ol
CID 133476628

Frequently Asked Questions

What is the IUPAC name of 4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one?
The IUPAC name of 4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one (CID 137008164) is 4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one is Cc1nc(N2CCOCC2CN)cc(=O)[nH]1.
What is the InChIKey of 4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one?
The InChIKey is AOWLAKZFBQKOID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-7-12-9(4-10(15)13-7)14-2-3-16-6-8(14)5-11/h4,8H,2-3,5-6,11H2,1H3,(H,12,13,15).
What are the key properties of 4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one?
4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one has a molecular weight of 224.26 g/mol, XLogP of -0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 137008164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).