4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine

C11H13N3S — CID 62958907

IUPAC4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine
SMILESCc1ccnc(NC(C)c2cccs2)n1
InChIInChI=1S/C11H13N3S/c1-8-5-6-12-11(13-8)14-9(2)10-4-3-7-15-10/h3-7,9H,1-2H3,(H,12,13,14)
InChIKeyRCYVHFVVDFELLE-UHFFFAOYSA-N
MW219.31 g/mol
LogP3.02
Rot. Bonds3

About 4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine

4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine (PubChem CID 62958907) has the molecular formula C11H13N3S and a molecular weight of 219.31 g/mol. Its IUPAC name is 4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine
PubChem CID62958907
Molecular FormulaC11H13N3S
Molecular Weight219.31 g/mol
Exact Mass219.08
IUPAC Name4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine
SMILESCc1ccnc(NC(C)c2cccs2)n1
InChIInChI=1S/C11H13N3S/c1-8-5-6-12-11(13-8)14-9(2)10-4-3-7-15-10/h3-7,9H,1-2H3,(H,12,13,14)
InChIKeyRCYVHFVVDFELLE-UHFFFAOYSA-N
XLogP3.02
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-thiophen-2-ylethyl)pyrimidin-2-amine
CID 43397770
4-methyl-N-[1-(4-methylphenyl)ethyl]pyrimidin-2-amine
CID 62958041
4-methyl-6-propoxy-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine
CID 112636733
N-[1-(4-fluorophenyl)ethyl]-4-methylpyrimidin-2-amine
CID 62960002
4-methyl-6-propan-2-yl-N-(1-thiophen-2-ylethyl)-1,3,5-triazin-2-amine;yttrium
CID 59879797
4,6-dimethoxy-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine
CID 115354957
N-benzhydryl-4-methylpyrimidin-2-amine
CID 62958031
4-methyl-N-(1-methylsulfanylpropan-2-yl)pyrimidin-2-amine
CID 115637582
N-but-3-en-2-yl-4-methylpyrimidin-2-amine
CID 115691968
6-ethoxy-4-N-methyl-2-N-(1-thiophen-2-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80781075
N-(1-thiophen-2-ylethyl)quinoxalin-2-amine
CID 47142874
6-ethoxy-2-N-(1-thiophen-2-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80780976

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine?
The IUPAC name of 4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine (CID 62958907) is 4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine.
What is the SMILES notation for 4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine?
The canonical SMILES for 4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine is Cc1ccnc(NC(C)c2cccs2)n1.
What is the InChIKey of 4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine?
The InChIKey is RCYVHFVVDFELLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3S/c1-8-5-6-12-11(13-8)14-9(2)10-4-3-7-15-10/h3-7,9H,1-2H3,(H,12,13,14).
What are the key properties of 4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine?
4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine has a molecular weight of 219.31 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine is sourced from PubChem (CID 62958907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).