N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine

C13H22N4O2 — CID 79072413

IUPACN-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine
SMILESCCCOc1cc(NCC2CN(C)CCO2)ncn1
InChIInChI=1S/C13H22N4O2/c1-3-5-19-13-7-12(15-10-16-13)14-8-11-9-17(2)4-6-18-11/h7,10-11H,3-6,8-9H2,1-2H3,(H,14,15,16)
InChIKeyWUMFZUJLRRWILA-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.01
Rot. Bonds6

About N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine

N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine (PubChem CID 79072413) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine.

Molecular Properties

Compound NameN-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine
PubChem CID79072413
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC NameN-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine
SMILESCCCOc1cc(NCC2CN(C)CCO2)ncn1
InChIInChI=1S/C13H22N4O2/c1-3-5-19-13-7-12(15-10-16-13)14-8-11-9-17(2)4-6-18-11/h7,10-11H,3-6,8-9H2,1-2H3,(H,14,15,16)
InChIKeyWUMFZUJLRRWILA-UHFFFAOYSA-N
XLogP1.01
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-N-methyl-4-N-[(4-methylmorpholin-2-yl)methyl]pyrimidine-4,6-diamine
CID 80850810
N-(1,4-dioxan-2-ylmethyl)-6-propoxypyrimidin-4-amine
CID 66328979
N-[(4-methylmorpholin-2-yl)methyl]-6-piperidin-1-ylpyrimidin-4-amine
CID 133280984
N-[(4-methylmorpholin-2-yl)methyl]-4-propoxypyrimidin-2-amine
CID 112638136
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-propoxypyrimidin-4-amine
CID 107389682
4-ethoxy-6-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine
CID 112638139
N-[(2-chlorocyclopentyl)methyl]-6-propoxypyrimidin-4-amine
CID 66333015
6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine
CID 80922854
2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]aniline
CID 79172087
4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine
CID 78952498
N-[(5-methyl-1,2-oxazol-3-yl)methyl]-6-propoxypyrimidin-4-amine
CID 66329191
5-[(4-methylmorpholin-2-yl)methylamino]pyrazine-2-carboxylic acid
CID 79070897

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine?
The IUPAC name of N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine (CID 79072413) is N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine.
What is the SMILES notation for N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine?
The canonical SMILES for N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine is CCCOc1cc(NCC2CN(C)CCO2)ncn1.
What is the InChIKey of N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine?
The InChIKey is WUMFZUJLRRWILA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-3-5-19-13-7-12(15-10-16-13)14-8-11-9-17(2)4-6-18-11/h7,10-11H,3-6,8-9H2,1-2H3,(H,14,15,16).
What are the key properties of N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine?
N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine has a molecular weight of 266.34 g/mol, XLogP of 1.01, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylmorpholin-2-yl)methyl]-6-propoxypyrimidin-4-amine is sourced from PubChem (CID 79072413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).