N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine

C13H22N4O — CID 55113870

IUPACN-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine
SMILESCCNCc1c(C)nc(N2CCOCC2)nc1C
InChIInChI=1S/C13H22N4O/c1-4-14-9-12-10(2)15-13(16-11(12)3)17-5-7-18-8-6-17/h14H,4-9H2,1-3H3
InChIKeyHHGGUVUSOIHPAR-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.04
Rot. Bonds4

About N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine

N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine (PubChem CID 55113870) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine
PubChem CID55113870
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine
SMILESCCNCc1c(C)nc(N2CCOCC2)nc1C
InChIInChI=1S/C13H22N4O/c1-4-14-9-12-10(2)15-13(16-11(12)3)17-5-7-18-8-6-17/h14H,4-9H2,1-3H3
InChIKeyHHGGUVUSOIHPAR-UHFFFAOYSA-N
XLogP1.04
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 ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine
CID 62744964
N-[(4,6-dimethyl-2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine
CID 62286271
2-[4,6-dimethyl-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]-N-ethylethanamine
CID 62745632
N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]ethanamine
CID 62745483
1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine
CID 62745478
N,5,6-trimethyl-2-morpholin-4-ylpyrimidin-4-amine
CID 62192217
N-[[2-(azepan-1-yl)-4,6-dimethylpyrimidin-5-yl]methyl]-2-methylpropan-1-amine
CID 62746715
N-(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)-3-methylbutanamide
CID 71807274
4-(4,6-dimethyl-1,3,5-triazin-2-yl)morpholine;ethane
CID 159951324
4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one
CID 135978215
N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 34253082
2-[4-(ethylaminomethyl)-3,5-dimethylpyrazol-1-yl]-1-morpholin-4-ylethanone
CID 43647773

Frequently Asked Questions

What is the IUPAC name of N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine?
The IUPAC name of N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine (CID 55113870) is N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine.
What is the SMILES notation for N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine?
The canonical SMILES for N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine is CCNCc1c(C)nc(N2CCOCC2)nc1C.
What is the InChIKey of N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine?
The InChIKey is HHGGUVUSOIHPAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-14-9-12-10(2)15-13(16-11(12)3)17-5-7-18-8-6-17/h14H,4-9H2,1-3H3.
What are the key properties of N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine?
N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine has a molecular weight of 250.35 g/mol, XLogP of 1.04, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine is sourced from PubChem (CID 55113870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).