N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine

C13H22N4O — CID 80657828

IUPACN-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine
SMILESCCNc1cc(C)nc(CN2CCOCC2C)n1
InChIInChI=1S/C13H22N4O/c1-4-14-12-7-10(2)15-13(16-12)8-17-5-6-18-9-11(17)3/h7,11H,4-6,8-9H2,1-3H3,(H,14,15,16)
InChIKeyYEXAIZONEUZOTR-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.44
Rot. Bonds4

About N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine

N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine (PubChem CID 80657828) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine
PubChem CID80657828
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine
SMILESCCNc1cc(C)nc(CN2CCOCC2C)n1
InChIInChI=1S/C13H22N4O/c1-4-14-12-7-10(2)15-13(16-12)8-17-5-6-18-9-11(17)3/h7,11H,4-6,8-9H2,1-3H3,(H,14,15,16)
InChIKeyYEXAIZONEUZOTR-UHFFFAOYSA-N
XLogP1.44
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-Isopropyl-6-methyl-4-pyrimidinyl)morpholine
CID 3306908
4,4'-(6-Methylpyrimidine-2,4-diyl)dimorpholine
CID 239982
2,4-Dimethyl-6-(piperazin-1-yl)pyrimidine
CID 4778269
4-Methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 3228743
4-methyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 24994945
4-(4-Methyl-6-piperidin-1-ylpyrimidin-2-yl)morpholine
CID 697254
4,6-dimethyl-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine
CID 1646798
4-[3-(Ethylamino)azetidin-1-yl]-6-methylpyrimidin-2-amine
CID 155533940
N,6-dimethyl-2-morpholin-4-ylpyrimidin-4-amine
CID 697248
4-(2-Isopropyl-6-methyl-4-pyrimidinyl)-2,6-dimethylmorpholine
CID 4317583
4-[4-Methyl-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]morpholine
CID 647957
N-butyl-6-methyl-2-(4-morpholinyl)-4-pyrimidinamine
CID 1880359

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine?
The IUPAC name of N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine (CID 80657828) is N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine is CCNc1cc(C)nc(CN2CCOCC2C)n1.
What is the InChIKey of N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine?
The InChIKey is YEXAIZONEUZOTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-14-12-7-10(2)15-13(16-12)8-17-5-6-18-9-11(17)3/h7,11H,4-6,8-9H2,1-3H3,(H,14,15,16).
What are the key properties of N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine?
N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine has a molecular weight of 250.35 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 80657828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).