2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine

C12H15N3S — CID 62203140

IUPAC2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1ccnc(-c2ccc(C)s2)n1
InChIInChI=1S/C12H15N3S/c1-3-7-13-11-6-8-14-12(15-11)10-5-4-9(2)16-10/h4-6,8H,3,7H2,1-2H3,(H,13,14,15)
InChIKeyFHRBQRMRMOFDOI-UHFFFAOYSA-N
MW233.34 g/mol
LogP3.34
Rot. Bonds4

About 2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine

2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine (PubChem CID 62203140) has the molecular formula C12H15N3S and a molecular weight of 233.34 g/mol. Its IUPAC name is 2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine
PubChem CID62203140
Molecular FormulaC12H15N3S
Molecular Weight233.34 g/mol
Exact Mass233.10
IUPAC Name2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1ccnc(-c2ccc(C)s2)n1
InChIInChI=1S/C12H15N3S/c1-3-7-13-11-6-8-14-12(15-11)10-5-4-9(2)16-10/h4-6,8H,3,7H2,1-2H3,(H,13,14,15)
InChIKeyFHRBQRMRMOFDOI-UHFFFAOYSA-N
XLogP3.34
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-propyl-2-(2,4,6-trimethylphenyl)pyrimidin-4-amine
CID 62201721
2-(5-methylfuran-2-yl)-N-propylpyrimidin-4-amine
CID 62203835
2-(4-bromo-3,5-dimethylphenyl)-N-propylpyrimidin-4-amine
CID 114330961
2-(4-methoxyphenyl)-N-propylpyrimidin-4-amine
CID 62191848
2-(3-bromofuran-2-yl)-N-propylpyrimidin-4-amine
CID 106889197
N-propyl-2-(2-propylpyrazol-3-yl)pyrimidin-4-amine
CID 114557298
2-(5-fluoro-2-pyridinyl)-N-propylpyrimidin-4-amine
CID 79717957
2-naphthalen-2-yl-N-propylpyrimidin-4-amine
CID 62202615
2-(1-benzothiophen-3-yl)-N-propylpyrimidin-4-amine
CID 62699425
2-(3-bromophenyl)-N-propylpyrimidin-4-amine
CID 55135437
6-N-[(5-methylthiophen-2-yl)methyl]-2-N-propylpyridine-2,6-diamine
CID 80817701
2-(1-ethylpyrazol-4-yl)-N-propylpyrimidin-4-amine
CID 103570486

Frequently Asked Questions

What is the IUPAC name of 2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine?
The IUPAC name of 2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine (CID 62203140) is 2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine is CCCNc1ccnc(-c2ccc(C)s2)n1.
What is the InChIKey of 2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine?
The InChIKey is FHRBQRMRMOFDOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3S/c1-3-7-13-11-6-8-14-12(15-11)10-5-4-9(2)16-10/h4-6,8H,3,7H2,1-2H3,(H,13,14,15).
What are the key properties of 2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine?
2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine has a molecular weight of 233.34 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylthiophen-2-yl)-N-propylpyrimidin-4-amine is sourced from PubChem (CID 62203140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).