6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine

C14H20N4OS — CID 97160152

IUPAC6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine
SMILESCOc1ncnc(N)c1CN(C)[C@@H](C)Cc1cccs1
InChIInChI=1S/C14H20N4OS/c1-10(7-11-5-4-6-20-11)18(2)8-12-13(15)16-9-17-14(12)19-3/h4-6,9-10H,7-8H2,1-3H3,(H2,15,16,17)/t10-/m0/s1
InChIKeyCMYLVVTXYKHQMX-JTQLQIEISA-N
MW292.41 g/mol
LogP2.19
Rot. Bonds6

About 6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine

6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine (PubChem CID 97160152) has the molecular formula C14H20N4OS and a molecular weight of 292.41 g/mol. Its IUPAC name is 6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine
PubChem CID97160152
Molecular FormulaC14H20N4OS
Molecular Weight292.41 g/mol
Exact Mass292.14
IUPAC Name6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine
SMILESCOc1ncnc(N)c1CN(C)[C@@H](C)Cc1cccs1
InChIInChI=1S/C14H20N4OS/c1-10(7-11-5-4-6-20-11)18(2)8-12-13(15)16-9-17-14(12)19-3/h4-6,9-10H,7-8H2,1-3H3,(H2,15,16,17)/t10-/m0/s1
InChIKeyCMYLVVTXYKHQMX-JTQLQIEISA-N
XLogP2.19
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.41
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine with MolForge

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Related Compounds

6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine
CID 97160147
6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine
CID 80657795
N'-methyl-N'-(1-thiophen-2-ylpropan-2-yl)ethane-1,2-diamine
CID 79470909
5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine
CID 79486505
3-N-methyl-3-N-(1-thiophen-2-ylpropan-2-yl)pyrazine-2,3-diamine
CID 113268505
N-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-thiophen-2-ylpropan-2-amine
CID 79476509
1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol
CID 79485730
5-chloro-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]aniline
CID 79476388
1-[2-[methyl(1-thiophen-2-ylpropan-2-yl)amino]ethyl]pyrazol-3-amine
CID 79471004
N-methyl-5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine
CID 79486431
N-[(3-bromophenyl)methyl]-N-methyl-1-thiophen-2-ylpropan-2-amine
CID 79485743
2-methyl-1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol
CID 79486869

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine?
The IUPAC name of 6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine (CID 97160152) is 6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine is COc1ncnc(N)c1CN(C)[C@@H](C)Cc1cccs1.
What is the InChIKey of 6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine?
The InChIKey is CMYLVVTXYKHQMX-JTQLQIEISA-N. The full InChI is InChI=1S/C14H20N4OS/c1-10(7-11-5-4-6-20-11)18(2)8-12-13(15)16-9-17-14(12)19-3/h4-6,9-10H,7-8H2,1-3H3,(H2,15,16,17)/t10-/m0/s1.
What are the key properties of 6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine?
6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine has a molecular weight of 292.41 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine is sourced from PubChem (CID 97160152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).