1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine

C17H30N4O — CID 99814648

IUPAC1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine
SMILESCc1nc(N2CCO[C@H](CN(C)C)C2)nc(C)c1CC(C)C
InChIInChI=1S/C17H30N4O/c1-12(2)9-16-13(3)18-17(19-14(16)4)21-7-8-22-15(11-21)10-20(5)6/h12,15H,7-11H2,1-6H3/t15-/m1/s1
InChIKeyNTLXPEPHWKBNMD-OAHLLOKOSA-N
MW306.45 g/mol
LogP2.06
Rot. Bonds5

About 1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine

1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine (PubChem CID 99814648) has the molecular formula C17H30N4O and a molecular weight of 306.45 g/mol. Its IUPAC name is 1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine
PubChem CID99814648
Molecular FormulaC17H30N4O
Molecular Weight306.45 g/mol
Exact Mass306.24
IUPAC Name1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine
SMILESCc1nc(N2CCO[C@H](CN(C)C)C2)nc(C)c1CC(C)C
InChIInChI=1S/C17H30N4O/c1-12(2)9-16-13(3)18-17(19-14(16)4)21-7-8-22-15(11-21)10-20(5)6/h12,15H,7-11H2,1-6H3/t15-/m1/s1
InChIKeyNTLXPEPHWKBNMD-OAHLLOKOSA-N
XLogP2.06
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.45
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine with MolForge

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Related Compounds

N,N-dimethyl-1-[4-(2-methylpropyl)morpholin-2-yl]methanamine
CID 123749859
2-(bromomethyl)-4-(5,6-dimethyl-1,2,4-triazin-3-yl)morpholine
CID 114787902
[4-[5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]methanamine
CID 116976328
1-[(2S)-4-(4-ethylsulfonylphenyl)morpholin-2-yl]-N,N-dimethylmethanamine
CID 99790126
N,N-dimethyl-1-[(2R)-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]morpholin-2-yl]methanamine
CID 95345198
1-[4-(5-ethyl-2-pyridinyl)morpholin-2-yl]-N,N-dimethylmethanamine
CID 70962971
2-[2-[(dimethylamino)methyl]morpholin-4-yl]propan-1-amine
CID 83831938
N,N-dimethyl-1-[(2S)-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholin-2-yl]methanamine
CID 172543618
N,N-dimethyl-1-[(2S)-4-[5-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]methanamine
CID 95314791
[(2S)-4-(5-ethyl-2,6-dimethylpyrimidin-4-yl)morpholin-2-yl]methanamine
CID 125436137
N,N-dimethyl-1-[(2S)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methanamine
CID 95332231
methyl 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)morpholin-2-yl]acetate
CID 114448691

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine (CID 99814648) is 1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine is Cc1nc(N2CCO[C@H](CN(C)C)C2)nc(C)c1CC(C)C.
What is the InChIKey of 1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine?
The InChIKey is NTLXPEPHWKBNMD-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H30N4O/c1-12(2)9-16-13(3)18-17(19-14(16)4)21-7-8-22-15(11-21)10-20(5)6/h12,15H,7-11H2,1-6H3/t15-/m1/s1.
What are the key properties of 1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine?
1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine has a molecular weight of 306.45 g/mol, XLogP of 2.06, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-4-[4,6-dimethyl-5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 99814648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).