5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine

C12H19ClN4O — CID 80764781

IUPAC5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine
SMILESCCNc1ncc(Cl)c(N2CC(C)OC(C)C2)n1
InChIInChI=1S/C12H19ClN4O/c1-4-14-12-15-5-10(13)11(16-12)17-6-8(2)18-9(3)7-17/h5,8-9H,4,6-7H2,1-3H3,(H,14,15,16)
InChIKeyVTGODVSLAKCUHH-UHFFFAOYSA-N
MW270.76 g/mol
LogP2.18
Rot. Bonds3

About 5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine

5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine (PubChem CID 80764781) has the molecular formula C12H19ClN4O and a molecular weight of 270.76 g/mol. Its IUPAC name is 5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine.

Molecular Properties

Compound Name5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine
PubChem CID80764781
Molecular FormulaC12H19ClN4O
Molecular Weight270.76 g/mol
Exact Mass270.12
IUPAC Name5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine
SMILESCCNc1ncc(Cl)c(N2CC(C)OC(C)C2)n1
InChIInChI=1S/C12H19ClN4O/c1-4-14-12-15-5-10(13)11(16-12)17-6-8(2)18-9(3)7-17/h5,8-9H,4,6-7H2,1-3H3,(H,14,15,16)
InChIKeyVTGODVSLAKCUHH-UHFFFAOYSA-N
XLogP2.18
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine 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-chloro-4-(3,4-dimethylpyrrolidin-1-yl)-N-propylpyrimidin-2-amine
CID 80848714
5-chloro-N-ethyl-4-piperazin-1-ylpyrimidin-2-amine
CID 80836911
4-(4-tert-butylpiperazin-1-yl)-5-chloro-N-ethylpyrimidin-2-amine
CID 80796160
4-[5-chloro-2-(ethylamino)pyrimidin-4-yl]piperazine-2,6-dione
CID 80855498
5-chloro-N-ethyl-4-(4-methyl-1,4-diazepan-1-yl)pyrimidin-2-amine
CID 80766486
5-chloro-4-(3,4-dimethoxypyrrolidin-1-yl)-N-propylpyrimidin-2-amine
CID 103542000
5-chloro-N-ethyl-4-(3-propoxypiperidin-1-yl)pyrimidin-2-amine
CID 80806982
5-chloro-4-(3-methylpyrrolidin-1-yl)-N-propylpyrimidin-2-amine
CID 80797839
4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine
CID 80767776
3,5-dichloro-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-propylpyridin-2-amine
CID 102760165
5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine
CID 80831106
5-bromo-4-(2,6-dimethylmorpholin-4-yl)-N-methylpyrimidin-2-amine
CID 80764445

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine?
The IUPAC name of 5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine (CID 80764781) is 5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine.
What is the SMILES notation for 5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine?
The canonical SMILES for 5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine is CCNc1ncc(Cl)c(N2CC(C)OC(C)C2)n1.
What is the InChIKey of 5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine?
The InChIKey is VTGODVSLAKCUHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19ClN4O/c1-4-14-12-15-5-10(13)11(16-12)17-6-8(2)18-9(3)7-17/h5,8-9H,4,6-7H2,1-3H3,(H,14,15,16).
What are the key properties of 5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine?
5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine has a molecular weight of 270.76 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine is sourced from PubChem (CID 80764781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).