4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine

C9H10N4OS — CID 104577405

IUPAC4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine
SMILESCOc1ccnc(NCc2cncs2)n1
InChIInChI=1S/C9H10N4OS/c1-14-8-2-3-11-9(13-8)12-5-7-4-10-6-15-7/h2-4,6H,5H2,1H3,(H,11,12,13)
InChIKeyGLBNTXHKSBHBBD-UHFFFAOYSA-N
MW222.27 g/mol
LogP1.55
Rot. Bonds4

About 4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine

4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine (PubChem CID 104577405) has the molecular formula C9H10N4OS and a molecular weight of 222.27 g/mol. Its IUPAC name is 4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine
PubChem CID104577405
Molecular FormulaC9H10N4OS
Molecular Weight222.27 g/mol
Exact Mass222.06
IUPAC Name4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine
SMILESCOc1ccnc(NCc2cncs2)n1
InChIInChI=1S/C9H10N4OS/c1-14-8-2-3-11-9(13-8)12-5-7-4-10-6-15-7/h2-4,6H,5H2,1H3,(H,11,12,13)
InChIKeyGLBNTXHKSBHBBD-UHFFFAOYSA-N
XLogP1.55
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-4-methoxypyrimidin-2-amine
CID 20510275
N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-4-methoxypyrimidin-2-amine
CID 113244193
2-(1,3-thiazol-5-ylmethylamino)pyrimidine-4-carboxylic acid
CID 107554461
4-methoxy-N-(1,3-thiazol-5-ylmethyl)aniline
CID 62760158
4-methoxy-N-(thiophen-3-ylmethyl)pyrimidin-2-amine
CID 112685174
1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine
CID 112684646
N-(2,2-difluoropropyl)-4-methoxypyrimidin-2-amine
CID 131107592
N-(3-chloro-2-methylpropyl)-4-methoxypyrimidin-2-amine
CID 65036818
4-methoxy-N-[(4-pyridin-3-ylphenyl)methyl]pyrimidin-2-amine
CID 133332712
N-(4-methoxypyrimidin-2-yl)-N'-propan-2-ylethane-1,2-diamine
CID 62664484
4-methoxy-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-2-amine
CID 78898230
N-[2-(furan-2-yl)-2-methoxyethyl]-4-methoxypyrimidin-2-amine
CID 172904275

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine?
The IUPAC name of 4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine (CID 104577405) is 4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine?
The canonical SMILES for 4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine is COc1ccnc(NCc2cncs2)n1.
What is the InChIKey of 4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine?
The InChIKey is GLBNTXHKSBHBBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4OS/c1-14-8-2-3-11-9(13-8)12-5-7-4-10-6-15-7/h2-4,6H,5H2,1H3,(H,11,12,13).
What are the key properties of 4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine?
4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine has a molecular weight of 222.27 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine is sourced from PubChem (CID 104577405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).