N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine

C15H15N3O2S — CID 44583613

IUPACN-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine
SMILESCOc1ccc(OC)c(N(C)c2ncnc3ccsc23)c1
InChIInChI=1S/C15H15N3O2S/c1-18(12-8-10(19-2)4-5-13(12)20-3)15-14-11(6-7-21-14)16-9-17-15/h4-9H,1-3H3
InChIKeyFDCCESUQILDHJQ-UHFFFAOYSA-N
MW301.37 g/mol
LogP3.48
Rot. Bonds4

About N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine

N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine (PubChem CID 44583613) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine
PubChem CID44583613
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC NameN-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine
SMILESCOc1ccc(OC)c(N(C)c2ncnc3ccsc23)c1
InChIInChI=1S/C15H15N3O2S/c1-18(12-8-10(19-2)4-5-13(12)20-3)15-14-11(6-7-21-14)16-9-17-15/h4-9H,1-3H3
InChIKeyFDCCESUQILDHJQ-UHFFFAOYSA-N
XLogP3.48
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,5-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 2508929
N-(2,5-dimethoxyphenyl)-6-phenylthieno[2,3-d]pyrimidin-4-amine
CID 2462466
N-(3,5-dimethoxyphenyl)thieno[3,2-d]pyrimidin-4-amine
CID 16058707
N-(4-methoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine
CID 16666960
N-(4-methoxyphenyl)-N,7-dimethylthieno[3,2-d]pyrimidin-4-amine
CID 16666962
N-(4-methoxyphenyl)-N,2-dimethylthieno[3,2-d]pyrimidin-4-amine
CID 44583630
N-(2-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 3314351
4-(4-Methoxyphenoxy)-2-(methylsulfanyl)thieno[3,2-d]pyrimidine
CID 1484666
N-(2,5-dimethoxyphenyl)-2-(6-methylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide
CID 6460337
4-N-(2,5-dimethoxyphenyl)-6-N-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine
CID 145978865
N-(3-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 2478999
N-[(4-methoxyphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine
CID 17433869

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine (CID 44583613) is N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine is COc1ccc(OC)c(N(C)c2ncnc3ccsc23)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine?
The InChIKey is FDCCESUQILDHJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S/c1-18(12-8-10(19-2)4-5-13(12)20-3)15-14-11(6-7-21-14)16-9-17-15/h4-9H,1-3H3.
What are the key properties of N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine?
N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine has a molecular weight of 301.37 g/mol, XLogP of 3.48, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-N-methylthieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 44583613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).