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

C14H20N4S — CID 80657795

IUPAC6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine
SMILESCc1cc(N)nc(CN(C)C(C)Cc2cccs2)n1
InChIInChI=1S/C14H20N4S/c1-10-7-13(15)17-14(16-10)9-18(3)11(2)8-12-5-4-6-19-12/h4-7,11H,8-9H2,1-3H3,(H2,15,16,17)
InChIKeyWJCAZSPLDVQREA-UHFFFAOYSA-N
MW276.41 g/mol
LogP2.49
Rot. Bonds5

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

6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine (PubChem CID 80657795) has the molecular formula C14H20N4S and a molecular weight of 276.41 g/mol. Its IUPAC name is 6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine
PubChem CID80657795
Molecular FormulaC14H20N4S
Molecular Weight276.41 g/mol
Exact Mass276.14
IUPAC Name6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine
SMILESCc1cc(N)nc(CN(C)C(C)Cc2cccs2)n1
InChIInChI=1S/C14H20N4S/c1-10-7-13(15)17-14(16-10)9-18(3)11(2)8-12-5-4-6-19-12/h4-7,11H,8-9H2,1-3H3,(H2,15,16,17)
InChIKeyWJCAZSPLDVQREA-UHFFFAOYSA-N
XLogP2.49
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine
CID 79486505
2-[(4-amino-6-methylpyrimidin-2-yl)methyl-methylamino]propan-1-ol
CID 104554411
N-[(3-bromophenyl)methyl]-N-methyl-1-thiophen-2-ylpropan-2-amine
CID 79485743
N-[[4-(aminomethyl)furan-2-yl]methyl]-N-methyl-1-thiophen-2-ylpropan-2-amine
CID 79485851
5-chloro-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]aniline
CID 79476388
N'-methyl-N'-(1-thiophen-2-ylpropan-2-yl)ethane-1,2-diamine
CID 79470909
2-N-ethyl-4-N,6-dimethyl-4-N-(1-thiophen-2-ylpropan-2-yl)pyrimidine-2,4-diamine
CID 80849189
6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine
CID 97160152
2-chloro-N,6-dimethyl-N-(1-thiophen-2-ylpropan-2-yl)pyrimidin-4-amine
CID 79488087
2-tert-butyl-4-N-methyl-4-N-(1-thiophen-2-ylpropan-2-yl)pyrimidine-4,6-diamine
CID 80959395
1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol
CID 79485730
N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]-1-thiophen-2-ylpropan-2-amine
CID 106906849

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine?
The IUPAC name of 6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine (CID 80657795) is 6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine?
The canonical SMILES for 6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine is Cc1cc(N)nc(CN(C)C(C)Cc2cccs2)n1.
What is the InChIKey of 6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine?
The InChIKey is WJCAZSPLDVQREA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4S/c1-10-7-13(15)17-14(16-10)9-18(3)11(2)8-12-5-4-6-19-12/h4-7,11H,8-9H2,1-3H3,(H2,15,16,17).
What are the key properties of 6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine?
6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine has a molecular weight of 276.41 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine is sourced from PubChem (CID 80657795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).