6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine

C12H19ClN4O — CID 80935880

IUPAC6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
SMILESCCc1nc(Cl)cc(NCCN2CCOCC2)n1
InChIInChI=1S/C12H19ClN4O/c1-2-11-15-10(13)9-12(16-11)14-3-4-17-5-7-18-8-6-17/h9H,2-8H2,1H3,(H,14,15,16)
InChIKeyRZKRPQBBAWIJSK-UHFFFAOYSA-N
MW270.76 g/mol
LogP1.44
Rot. Bonds5

About 6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine

6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine (PubChem CID 80935880) has the molecular formula C12H19ClN4O and a molecular weight of 270.76 g/mol. Its IUPAC name is 6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
PubChem CID80935880
Molecular FormulaC12H19ClN4O
Molecular Weight270.76 g/mol
Exact Mass270.12
IUPAC Name6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
SMILESCCc1nc(Cl)cc(NCCN2CCOCC2)n1
InChIInChI=1S/C12H19ClN4O/c1-2-11-15-10(13)9-12(16-11)14-3-4-17-5-7-18-8-6-17/h9H,2-8H2,1H3,(H,14,15,16)
InChIKeyRZKRPQBBAWIJSK-UHFFFAOYSA-N
XLogP1.44
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-N-(3-morpholin-4-ylpropyl)-2-propylpyrimidin-4-amine
CID 80940890
6-chloro-2-propyl-N-(2-pyrrolidin-1-ylethyl)pyrimidin-4-amine
CID 80939981
2-chloro-N-(2-morpholin-4-ylethyl)-6-propylpyrimidin-4-amine
CID 82460824
2-tert-butyl-6-chloro-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 80945888
6-chloro-N-(2-morpholin-4-ylethyl)-4-nitropyridin-2-amine
CID 113345971
2-ethyl-6-N-propyl-4-N-(2-pyrrolidin-1-ylethyl)pyrimidine-4,6-diamine
CID 80934686
6-methyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 67328297
6-chloro-2-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
CID 80936355
4-[(6-chloro-2-ethylpyrimidin-4-yl)amino]butan-1-ol
CID 106842944
6-bromo-2-ethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]pyrimidin-4-amine
CID 114156436
2-cyclopropyl-6-N-methyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 80956267
6-chloro-2-ethyl-N-(oxolan-3-ylmethyl)pyrimidin-4-amine
CID 80936100

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
The IUPAC name of 6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine (CID 80935880) is 6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
The canonical SMILES for 6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine is CCc1nc(Cl)cc(NCCN2CCOCC2)n1.
What is the InChIKey of 6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
The InChIKey is RZKRPQBBAWIJSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19ClN4O/c1-2-11-15-10(13)9-12(16-11)14-3-4-17-5-7-18-8-6-17/h9H,2-8H2,1H3,(H,14,15,16).
What are the key properties of 6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine has a molecular weight of 270.76 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-ethyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine is sourced from PubChem (CID 80935880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).