5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride

C13H23Cl2N5O2 — CID 121396239

IUPAC5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride
SMILESCc1c(N2CCOCC2)nc(N)nc1N1CCOCC1.Cl.Cl
InChIInChI=1S/C13H21N5O2.2ClH/c1-10-11(17-2-6-19-7-3-17)15-13(14)16-12(10)18-4-8-20-9-5-18;;/h2-9H2,1H3,(H2,14,15,16);2*1H
InChIKeyOADFKLSGWGFOHM-UHFFFAOYSA-N
MW352.27 g/mol
LogP0.88
Rot. Bonds2

About 5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride

5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride (PubChem CID 121396239) has the molecular formula C13H23Cl2N5O2 and a molecular weight of 352.27 g/mol. Its IUPAC name is 5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride.

Molecular Properties

Compound Name5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride
PubChem CID121396239
Molecular FormulaC13H23Cl2N5O2
Molecular Weight352.27 g/mol
Exact Mass351.12
IUPAC Name5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride
SMILESCc1c(N2CCOCC2)nc(N)nc1N1CCOCC1.Cl.Cl
InChIInChI=1S/C13H21N5O2.2ClH/c1-10-11(17-2-6-19-7-3-17)15-13(14)16-12(10)18-4-8-20-9-5-18;;/h2-9H2,1H3,(H2,14,15,16);2*1H
InChIKeyOADFKLSGWGFOHM-UHFFFAOYSA-N
XLogP0.88
TPSA76.74 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.27
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-morpholin-4-yl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-amine
CID 83863076
4-(4-chloro-5-methyl-6-morpholin-4-ylpyrimidin-2-yl)aniline
CID 89181841
5-methyl-6-(1,4-oxazepan-4-yl)-2-propylpyrimidin-4-amine
CID 80985559
5-bromo-4-methyl-6-morpholin-4-ylpyridin-3-amine
CID 104506171
2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80770087
4-N,4-N-dimethyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 27396187
4-chloro-5-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 25133967
4-(azepan-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80764187
7-bromo-4-morpholin-4-ylquinazolin-2-amine
CID 133057180
4-morpholin-4-yl-6-propan-2-yl-1,3,5-triazin-2-amine
CID 63868604
6-(5-methylfuran-2-yl)-4-morpholin-4-ylpteridin-2-amine
CID 68775571
4-(5,6-dichloro-2-methylpyrimidin-4-yl)morpholine
CID 134511412

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride?
The IUPAC name of 5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride (CID 121396239) is 5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride.
What is the SMILES notation for 5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride?
The canonical SMILES for 5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride is Cc1c(N2CCOCC2)nc(N)nc1N1CCOCC1.Cl.Cl.
What is the InChIKey of 5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride?
The InChIKey is OADFKLSGWGFOHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O2.2ClH/c1-10-11(17-2-6-19-7-3-17)15-13(14)16-12(10)18-4-8-20-9-5-18;;/h2-9H2,1H3,(H2,14,15,16);2*1H.
What are the key properties of 5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride?
5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride has a molecular weight of 352.27 g/mol, XLogP of 0.88, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4,6-dimorpholin-4-ylpyrimidin-2-amine;dihydrochloride is sourced from PubChem (CID 121396239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).