4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine

C12H20N4O — CID 78952498

IUPAC4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine
SMILESCc1cc(C)nc(NCC2CN(C)CCO2)n1
InChIInChI=1S/C12H20N4O/c1-9-6-10(2)15-12(14-9)13-7-11-8-16(3)4-5-17-11/h6,11H,4-5,7-8H2,1-3H3,(H,13,14,15)
InChIKeyFEIKIDYMIVVFJL-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.84
Rot. Bonds3

About 4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine

4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine (PubChem CID 78952498) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine.

Molecular Properties

Compound Name4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine
PubChem CID78952498
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine
SMILESCc1cc(C)nc(NCC2CN(C)CCO2)n1
InChIInChI=1S/C12H20N4O/c1-9-6-10(2)15-12(14-9)13-7-11-8-16(3)4-5-17-11/h6,11H,4-5,7-8H2,1-3H3,(H,13,14,15)
InChIKeyFEIKIDYMIVVFJL-UHFFFAOYSA-N
XLogP0.84
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-ethoxy-6-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine
CID 112638139
5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine
CID 124594370
N-[(4-methylmorpholin-2-yl)methyl]-1,2,4-benzotriazin-3-amine
CID 103204381
3-N-[(4-methylmorpholin-2-yl)methyl]-1H-1,2,4-triazole-3,5-diamine
CID 79071706
6-chloro-2-N-[(4-methylmorpholin-2-yl)methyl]-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80850407
N-[(1,4-dimethylpiperazin-2-yl)methyl]-4,6-dimethylpyrimidin-2-amine
CID 63899169
4-chloro-N-[(4-methylmorpholin-2-yl)methyl]-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 79071314
3,5-difluoro-N-[(4-methylmorpholin-2-yl)methyl]aniline
CID 79171790
N-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-ylmethyl)-4,6-dimethylpyrimidin-2-amine
CID 79071229
N-[[(2R)-4-methylmorpholin-2-yl]methyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 95160947
1-cyclopentyl-4-methyl-N-[(4-methylmorpholin-2-yl)methyl]imidazol-2-amine
CID 106576055
6-N-methyl-4-N-[(4-methylmorpholin-2-yl)methyl]pyrimidine-4,6-diamine
CID 80850810

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine?
The IUPAC name of 4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine (CID 78952498) is 4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine.
What is the SMILES notation for 4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine?
The canonical SMILES for 4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine is Cc1cc(C)nc(NCC2CN(C)CCO2)n1.
What is the InChIKey of 4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine?
The InChIKey is FEIKIDYMIVVFJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-9-6-10(2)15-12(14-9)13-7-11-8-16(3)4-5-17-11/h6,11H,4-5,7-8H2,1-3H3,(H,13,14,15).
What are the key properties of 4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine?
4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine has a molecular weight of 236.32 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine is sourced from PubChem (CID 78952498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).