5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one

C10H17N5O2 — CID 136783272

IUPAC5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one
SMILESCC1CN(c2nc[nH]c(=O)c2N)CC(CN)O1
InChIInChI=1S/C10H17N5O2/c1-6-3-15(4-7(2-11)17-6)9-8(12)10(16)14-5-13-9/h5-7H,2-4,11-12H2,1H3,(H,13,14,16)
InChIKeyOOMZXKNZNXDFCA-UHFFFAOYSA-N
MW239.28 g/mol
LogP-1.10
Rot. Bonds2

About 5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one

5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one (PubChem CID 136783272) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is 5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one
PubChem CID136783272
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC Name5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one
SMILESCC1CN(c2nc[nH]c(=O)c2N)CC(CN)O1
InChIInChI=1S/C10H17N5O2/c1-6-3-15(4-7(2-11)17-6)9-8(12)10(16)14-5-13-9/h5-7H,2-4,11-12H2,1H3,(H,13,14,16)
InChIKeyOOMZXKNZNXDFCA-UHFFFAOYSA-N
XLogP-1.10
TPSA110.26 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-1.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-6-(propan-2-yloxymethyl)-5,6,7,8-tetrahydro-3H-pteridin-4-one
CID 135674619
5,6-Diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one
CID 139217219
4-amino-5-morpholin-4-yl-1H-pyrimidin-6-one
CID 136393190
3-(2-amino-6-oxo-7,8-dihydro-1H-purin-9-yl)-N-(2-morpholin-4-ylethyl)propanamide
CID 136477485
3-(2-amino-6-oxo-7,8-dihydro-1H-purin-9-yl)-N-(3-morpholin-4-ylpropyl)propanamide
CID 136477499
2-amino-5-(methylamino)-4-[(4-methylmorpholin-2-yl)amino]-1H-pyrimidin-6-one
CID 137179244
2-amino-9-(6-ethyl-4-methylmorpholin-2-yl)-7,8-dihydro-1H-purin-6-one
CID 167063297
5-amino-4-[(6-methylmorpholin-2-yl)methoxy]-1H-pyrimidin-6-one
CID 102635012
5-Amino-6-chloro-3-[(4-ethylmorpholin-2-yl)methyl]pyrimidin-4-one
CID 113604265
5-Amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one
CID 114582603
5-Amino-6-chloro-3-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrimidin-4-one
CID 114582816
5-amino-4-[(6,6-dimethylmorpholin-2-yl)methoxy]-1H-pyrimidin-6-one
CID 114775767

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one?
The IUPAC name of 5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one (CID 136783272) is 5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one.
What is the SMILES notation for 5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one?
The canonical SMILES for 5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one is CC1CN(c2nc[nH]c(=O)c2N)CC(CN)O1.
What is the InChIKey of 5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one?
The InChIKey is OOMZXKNZNXDFCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-6-3-15(4-7(2-11)17-6)9-8(12)10(16)14-5-13-9/h5-7H,2-4,11-12H2,1H3,(H,13,14,16).
What are the key properties of 5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one?
5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one has a molecular weight of 239.28 g/mol, XLogP of -1.10, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one is sourced from PubChem (CID 136783272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).