N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine

C10H8F3N3S — CID 706195

IUPACN-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine
SMILESCNc1nc(-c2cccs2)cc(C(F)(F)F)n1
InChIInChI=1S/C10H8F3N3S/c1-14-9-15-6(7-3-2-4-17-7)5-8(16-9)10(11,12)13/h2-5H,1H3,(H,14,15,16)
InChIKeyDDRAYDPWDQTUKV-UHFFFAOYSA-N
MW259.26 g/mol
LogP3.27
Rot. Bonds2

About N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine

N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine (PubChem CID 706195) has the molecular formula C10H8F3N3S and a molecular weight of 259.26 g/mol. Its IUPAC name is N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine.

Molecular Properties

Compound NameN-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine
PubChem CID706195
Molecular FormulaC10H8F3N3S
Molecular Weight259.26 g/mol
Exact Mass259.04
IUPAC NameN-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine
SMILESCNc1nc(-c2cccs2)cc(C(F)(F)F)n1
InChIInChI=1S/C10H8F3N3S/c1-14-9-15-6(7-3-2-4-17-7)5-8(16-9)10(11,12)13/h2-5H,1H3,(H,14,15,16)
InChIKeyDDRAYDPWDQTUKV-UHFFFAOYSA-N
XLogP3.27
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.26
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(Thiophen-2-yl)pyrimidin-2-amine
CID 2764407
Pyrimidine, 2-(ethylsulfonyl)-4-(2-thienyl)-6-(trifluoromethyl)-
CID 17024838
N-methyl-N-[4-(2-thienyl)-2-pyrimidinyl]cyanamide
CID 1478182
2-Methylsulfonyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidine
CID 3245258
N-ethyl-4-thiophen-2-ylthieno[3,2-d]pyrimidin-2-amine
CID 44449745
4-Methyl-2-methylsulfonyl-6-thiophen-2-ylpyrimidine
CID 97755228
N,N-dimethyl-N'-(4-thiophen-2-ylpyrimidin-2-yl)methanimidamide
CID 9633938
2-Chloro-4-(thiophen-2-yl)pyrimidine
CID 14117941
4-[4-(2-Thienyl)-6-(trifluoromethyl)-2-pyrimidinyl]morpholine
CID 756560
N-Isobutyl-2-(4-thiophen-2-yl-6-trifluoromethyl-pyrimidin-2-ylsulfanyl)-acetamide
CID 1152385
N-methyl-4-(phenylsulfanyl)-6-(trifluoromethyl)-2-pyrimidinamine
CID 1483266
[6-(Difluoromethyl)-4-(4-methylphenyl)pyrimidin-2-yl](2-thienylmethyl)amine
CID 2986321

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine?
The IUPAC name of N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine (CID 706195) is N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine.
What is the SMILES notation for N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine?
The canonical SMILES for N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine is CNc1nc(-c2cccs2)cc(C(F)(F)F)n1.
What is the InChIKey of N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine?
The InChIKey is DDRAYDPWDQTUKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3N3S/c1-14-9-15-6(7-3-2-4-17-7)5-8(16-9)10(11,12)13/h2-5H,1H3,(H,14,15,16).
What are the key properties of N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine?
N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine has a molecular weight of 259.26 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-amine is sourced from PubChem (CID 706195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).