[6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine

C10H11N3S — CID 121206379

IUPAC[6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine
SMILESNCc1cc(Cc2cccs2)ncn1
InChIInChI=1S/C10H11N3S/c11-6-9-4-8(12-7-13-9)5-10-2-1-3-14-10/h1-4,7H,5-6,11H2
InChIKeyLCNKUVAIOVUELI-UHFFFAOYSA-N
MW205.29 g/mol
LogP1.59
Rot. Bonds3

About [6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine

[6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine (PubChem CID 121206379) has the molecular formula C10H11N3S and a molecular weight of 205.29 g/mol. Its IUPAC name is [6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine.

Molecular Properties

Compound Name[6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine
PubChem CID121206379
Molecular FormulaC10H11N3S
Molecular Weight205.29 g/mol
Exact Mass205.07
IUPAC Name[6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine
SMILESNCc1cc(Cc2cccs2)ncn1
InChIInChI=1S/C10H11N3S/c11-6-9-4-8(12-7-13-9)5-10-2-1-3-14-10/h1-4,7H,5-6,11H2
InChIKeyLCNKUVAIOVUELI-UHFFFAOYSA-N
XLogP1.59
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(thiophen-2-ylmethoxy)-2-pyridinyl]methanamine
CID 62321392
[2-(thiophen-2-ylmethyl)-1,3-oxazol-5-yl]methanamine
CID 115087573
2-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-4-amine
CID 79470815
anthracene;thiophen-2-ylmethanamine
CID 175494003
5-(thiophen-2-ylmethyl)-1H-1,2,4-triazole
CID 118564355
[2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 117135650
2-(aminomethyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridin-4-amine
CID 62286889
5-(thiophen-2-ylmethyl)pyrimidine
CID 166530274
2-(aminomethyl)-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 112522093
4-(thiophen-2-ylmethyl)pteridine
CID 69024679
(1S)-1-[4-methyl-2-(thiophen-2-ylmethyl)pyrimidin-5-yl]ethanamine
CID 94587586
4-methyl-2-(thiophen-2-ylmethyl)pyrimidin-5-amine
CID 130483640

Frequently Asked Questions

What is the IUPAC name of [6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine?
The IUPAC name of [6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine (CID 121206379) is [6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine.
What is the SMILES notation for [6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine?
The canonical SMILES for [6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine is NCc1cc(Cc2cccs2)ncn1.
What is the InChIKey of [6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine?
The InChIKey is LCNKUVAIOVUELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3S/c11-6-9-4-8(12-7-13-9)5-10-2-1-3-14-10/h1-4,7H,5-6,11H2.
What are the key properties of [6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine?
[6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine has a molecular weight of 205.29 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine is sourced from PubChem (CID 121206379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).