N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine

C10H12N4S — CID 102923665

IUPACN-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine
SMILESCNC(Cc1nccs1)c1cncnc1
InChIInChI=1S/C10H12N4S/c1-11-9(4-10-14-2-3-15-10)8-5-12-7-13-6-8/h2-3,5-7,9,11H,4H2,1H3
InChIKeyYIBDSTITTHXCKB-UHFFFAOYSA-N
MW220.30 g/mol
LogP1.44
Rot. Bonds4

About N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine

N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine (PubChem CID 102923665) has the molecular formula C10H12N4S and a molecular weight of 220.30 g/mol. Its IUPAC name is N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine
PubChem CID102923665
Molecular FormulaC10H12N4S
Molecular Weight220.30 g/mol
Exact Mass220.08
IUPAC NameN-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine
SMILESCNC(Cc1nccs1)c1cncnc1
InChIInChI=1S/C10H12N4S/c1-11-9(4-10-14-2-3-15-10)8-5-12-7-13-6-8/h2-3,5-7,9,11H,4H2,1H3
InChIKeyYIBDSTITTHXCKB-UHFFFAOYSA-N
XLogP1.44
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(1-methylpyrazol-4-yl)-2-(1,3-thiazol-2-yl)ethanamine
CID 79824383
1-[4-(difluoromethoxy)phenyl]-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 105015149
1-(furan-2-yl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 79825248
1-(6-methoxypyrimidin-4-yl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 102951016
1-(2-bromo-6-fluorophenyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 114886949
1-(5-ethylthiophen-2-yl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 105015058
1-(2,5-dibromothiophen-3-yl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 107968755
1-isoquinolin-1-yl-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 79824265
2-(methylamino)-3-(1,3-thiazol-2-yl)propane-1-thiol
CID 20699494
1-(2-bromo-5-methylphenyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 105014961
2-(1-benzothiophen-3-yl)-N-methyl-1-pyrimidin-5-ylethanamine
CID 102923329
1-(2-methoxypyrimidin-5-yl)-N-methyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 112747522

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine?
The IUPAC name of N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine (CID 102923665) is N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine is CNC(Cc1nccs1)c1cncnc1.
What is the InChIKey of N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine?
The InChIKey is YIBDSTITTHXCKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4S/c1-11-9(4-10-14-2-3-15-10)8-5-12-7-13-6-8/h2-3,5-7,9,11H,4H2,1H3.
What are the key properties of N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine?
N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine has a molecular weight of 220.30 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-pyrimidin-5-yl-2-(1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 102923665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).