(3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine

C10H11N3S — CID 115827446

IUPAC(3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine
SMILESCc1ccsc1C(N)c1cncnc1
InChIInChI=1S/C10H11N3S/c1-7-2-3-14-10(7)9(11)8-4-12-6-13-5-8/h2-6,9H,11H2,1H3
InChIKeyMYBRTZSGDUPJDE-UHFFFAOYSA-N
MW205.29 g/mol
LogP1.89
Rot. Bonds2

About (3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine

(3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine (PubChem CID 115827446) has the molecular formula C10H11N3S and a molecular weight of 205.29 g/mol. Its IUPAC name is (3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine.

Molecular Properties

Compound Name(3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine
PubChem CID115827446
Molecular FormulaC10H11N3S
Molecular Weight205.29 g/mol
Exact Mass205.07
IUPAC Name(3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine
SMILESCc1ccsc1C(N)c1cncnc1
InChIInChI=1S/C10H11N3S/c1-7-2-3-14-10(7)9(11)8-4-12-6-13-5-8/h2-6,9H,11H2,1H3
InChIKeyMYBRTZSGDUPJDE-UHFFFAOYSA-N
XLogP1.89
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-methylthiophen-2-yl)-pyridin-3-ylmethanamine
CID 78973972
(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine
CID 115854886
(3-methylthiophen-2-yl)-(1H-pyrazol-4-yl)methanamine
CID 82236060
3-[amino-(3-methylthiophen-2-yl)methyl]aniline
CID 116936643
di(pyrimidin-5-yl)methanamine
CID 102923336
(3-methylthiophen-2-yl)-(2,3,5,6-tetramethylphenyl)methanamine
CID 43384383
(3-methylthiophen-2-yl)-pyridin-2-ylmethanamine
CID 79989254
2,3-dihydro-1H-inden-5-yl-(3-methylthiophen-2-yl)methanamine
CID 43464476
(6-methoxypyrimidin-4-yl)-(3-methylthiophen-2-yl)methanamine
CID 102950671
(2-methylpyrimidin-4-yl)-(3-methylthiophen-2-yl)methanamine
CID 115530132
(1S)-2,2-difluoro-1-(3-methylthiophen-2-yl)ethanamine
CID 130649294
(3-chloro-4-methoxyphenyl)-(3-methylthiophen-2-yl)methanamine
CID 43464562

Frequently Asked Questions

What is the IUPAC name of (3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine?
The IUPAC name of (3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine (CID 115827446) is (3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine.
What is the SMILES notation for (3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine?
The canonical SMILES for (3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine is Cc1ccsc1C(N)c1cncnc1.
What is the InChIKey of (3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine?
The InChIKey is MYBRTZSGDUPJDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3S/c1-7-2-3-14-10(7)9(11)8-4-12-6-13-5-8/h2-6,9H,11H2,1H3.
What are the key properties of (3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine?
(3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine has a molecular weight of 205.29 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine is sourced from PubChem (CID 115827446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).