6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine

C12H17N3O2S — CID 103331522

IUPAC6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine
SMILESCc1cc2c(OCCOC(C)C)nc(N)nc2s1
InChIInChI=1S/C12H17N3O2S/c1-7(2)16-4-5-17-10-9-6-8(3)18-11(9)15-12(13)14-10/h6-7H,4-5H2,1-3H3,(H2,13,14,15)
InChIKeyJQKWRDKDNFWABI-UHFFFAOYSA-N
MW267.35 g/mol
LogP2.39
Rot. Bonds5

About 6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine

6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine (PubChem CID 103331522) has the molecular formula C12H17N3O2S and a molecular weight of 267.35 g/mol. Its IUPAC name is 6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine
PubChem CID103331522
Molecular FormulaC12H17N3O2S
Molecular Weight267.35 g/mol
Exact Mass267.10
IUPAC Name6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine
SMILESCc1cc2c(OCCOC(C)C)nc(N)nc2s1
InChIInChI=1S/C12H17N3O2S/c1-7(2)16-4-5-17-10-9-6-8(3)18-11(9)15-12(13)14-10/h6-7H,4-5H2,1-3H3,(H2,13,14,15)
InChIKeyJQKWRDKDNFWABI-UHFFFAOYSA-N
XLogP2.39
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-heptoxy-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103331259
6-methyl-4-(4,4,4-trifluorobutoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103333279
4-butan-2-ylsulfanyl-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103334135
4-[(3-chlorophenyl)methoxy]-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103332823
6-methyl-4-N-(3-methylpentan-2-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103325883
4-(2-ethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103332009
6-ethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]thieno[2,3-d]pyrimidin-2-amine
CID 103333367
2-(2-amino-6-ethylthieno[2,3-d]pyrimidin-4-yl)oxyethanol
CID 103331574
4-N-(2-ethoxypropyl)-6-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103330055
6-methyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine
CID 103331947
4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103331767
3-(2-amino-6-ethylthieno[2,3-d]pyrimidin-4-yl)oxypropan-1-ol
CID 103331610

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine (CID 103331522) is 6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine is Cc1cc2c(OCCOC(C)C)nc(N)nc2s1.
What is the InChIKey of 6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine?
The InChIKey is JQKWRDKDNFWABI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2S/c1-7(2)16-4-5-17-10-9-6-8(3)18-11(9)15-12(13)14-10/h6-7H,4-5H2,1-3H3,(H2,13,14,15).
What are the key properties of 6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine?
6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine has a molecular weight of 267.35 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(2-propan-2-yloxyethoxy)thieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103331522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).