2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine

C14H25N5O — CID 95342290

IUPAC2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine
SMILESCc1cc(N(C)C)nc(N2CCO[C@@H](CN(C)C)C2)n1
InChIInChI=1S/C14H25N5O/c1-11-8-13(18(4)5)16-14(15-11)19-6-7-20-12(10-19)9-17(2)3/h8,12H,6-7,9-10H2,1-5H3/t12-/m0/s1
InChIKeyASOHPWKWJHRYSJ-LBPRGKRZSA-N
MW279.39 g/mol
LogP0.62
Rot. Bonds4

About 2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine

2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine (PubChem CID 95342290) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is 2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine
PubChem CID95342290
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine
SMILESCc1cc(N(C)C)nc(N2CCO[C@@H](CN(C)C)C2)n1
InChIInChI=1S/C14H25N5O/c1-11-8-13(18(4)5)16-14(15-11)19-6-7-20-12(10-19)9-17(2)3/h8,12H,6-7,9-10H2,1-5H3/t12-/m0/s1
InChIKeyASOHPWKWJHRYSJ-LBPRGKRZSA-N
XLogP0.62
TPSA44.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine with MolForge

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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
4-(4,6-Dimethylpyrimidin-2-yl)morpholine
CID 676802
4-Methyl-2,6-di(piperidin-1-yl)pyrimidine
CID 893737
4-Methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 3228743
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
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
2-Amino-4-piperidino-6-methylpyrimidine
CID 748221

Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine?
The IUPAC name of 2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine (CID 95342290) is 2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine.
What is the SMILES notation for 2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine?
The canonical SMILES for 2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine is Cc1cc(N(C)C)nc(N2CCO[C@@H](CN(C)C)C2)n1.
What is the InChIKey of 2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine?
The InChIKey is ASOHPWKWJHRYSJ-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H25N5O/c1-11-8-13(18(4)5)16-14(15-11)19-6-7-20-12(10-19)9-17(2)3/h8,12H,6-7,9-10H2,1-5H3/t12-/m0/s1.
What are the key properties of 2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine?
2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine has a molecular weight of 279.39 g/mol, XLogP of 0.62, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-N,N,6-trimethylpyrimidin-4-amine is sourced from PubChem (CID 95342290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).