5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one

C10H15ClN4O2 — CID 114582603

IUPAC5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one
SMILESCN1CCOC(Cn2cnc(Cl)c(N)c2=O)C1
InChIInChI=1S/C10H15ClN4O2/c1-14-2-3-17-7(4-14)5-15-6-13-9(11)8(12)10(15)16/h6-7H,2-5,12H2,1H3
InChIKeyDODWYBNQCXLMTD-UHFFFAOYSA-N
MW258.71 g/mol
LogP-0.19
Rot. Bonds2

About 5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one

5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one (PubChem CID 114582603) has the molecular formula C10H15ClN4O2 and a molecular weight of 258.71 g/mol. Its IUPAC name is 5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one.

Molecular Properties

Compound Name5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one
PubChem CID114582603
Molecular FormulaC10H15ClN4O2
Molecular Weight258.71 g/mol
Exact Mass258.09
IUPAC Name5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one
SMILESCN1CCOC(Cn2cnc(Cl)c(N)c2=O)C1
InChIInChI=1S/C10H15ClN4O2/c1-14-2-3-17-7(4-14)5-15-6-13-9(11)8(12)10(15)16/h6-7H,2-5,12H2,1H3
InChIKeyDODWYBNQCXLMTD-UHFFFAOYSA-N
XLogP-0.19
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.71
LogP ≤ 5-0.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-Amino-6-chloro-3-[2-(3-methoxypropoxy)ethyl]pyrimidin-4-one
CID 103182131
5-Amino-6-chloro-3-(2-propoxyethyl)pyrimidin-4-one
CID 106455821
5-Amino-6-chloro-3-[(4-ethylmorpholin-2-yl)methyl]pyrimidin-4-one
CID 113604265
5-Amino-6-chloro-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrimidin-4-one
CID 114582454
5-Amino-3-(2-butoxyethyl)-6-chloropyrimidin-4-one
CID 114582486
5-Amino-6-chloro-3-(2-propan-2-yloxyethyl)pyrimidin-4-one
CID 114582529
5-Amino-6-chloro-3-[2-(2-methoxyethoxy)ethyl]pyrimidin-4-one
CID 114582561
5-Amino-6-chloro-3-(1-methoxypropan-2-yl)pyrimidin-4-one
CID 114582562
5-Amino-6-chloro-3-(2-morpholin-4-yl-2-oxoethyl)pyrimidin-4-one
CID 114582632
5-Amino-6-chloro-3-(2-ethoxyethyl)pyrimidin-4-one
CID 114582679
5-Amino-6-chloro-3-(2-methoxyethyl)pyrimidin-4-one
CID 114582718
5-Amino-6-chloro-3-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrimidin-4-one
CID 114582757

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one?
The IUPAC name of 5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one (CID 114582603) is 5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one.
What is the SMILES notation for 5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one?
The canonical SMILES for 5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one is CN1CCOC(Cn2cnc(Cl)c(N)c2=O)C1.
What is the InChIKey of 5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one?
The InChIKey is DODWYBNQCXLMTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4O2/c1-14-2-3-17-7(4-14)5-15-6-13-9(11)8(12)10(15)16/h6-7H,2-5,12H2,1H3.
What are the key properties of 5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one?
5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one has a molecular weight of 258.71 g/mol, XLogP of -0.19, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-chloro-3-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-one is sourced from PubChem (CID 114582603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).