N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine

C19H16N4OS — CID 44583629

IUPACN-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine
SMILESCOc1ccc(N(C)c2ncnc3cc(-c4cccnc4)sc23)cc1
InChIInChI=1S/C19H16N4OS/c1-23(14-5-7-15(24-2)8-6-14)19-18-16(21-12-22-19)10-17(25-18)13-4-3-9-20-11-13/h3-12H,1-2H3
InChIKeyYAEPFUAEUCXVSK-UHFFFAOYSA-N
MW348.43 g/mol
LogP4.53
Rot. Bonds4

About N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine

N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine (PubChem CID 44583629) has the molecular formula C19H16N4OS and a molecular weight of 348.43 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine
PubChem CID44583629
Molecular FormulaC19H16N4OS
Molecular Weight348.43 g/mol
Exact Mass348.10
IUPAC NameN-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine
SMILESCOc1ccc(N(C)c2ncnc3cc(-c4cccnc4)sc23)cc1
InChIInChI=1S/C19H16N4OS/c1-23(14-5-7-15(24-2)8-6-14)19-18-16(21-12-22-19)10-17(25-18)13-4-3-9-20-11-13/h3-12H,1-2H3
InChIKeyYAEPFUAEUCXVSK-UHFFFAOYSA-N
XLogP4.53
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.43
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine (CID 44583629) is N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine is COc1ccc(N(C)c2ncnc3cc(-c4cccnc4)sc23)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine?
The InChIKey is YAEPFUAEUCXVSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4OS/c1-23(14-5-7-15(24-2)8-6-14)19-18-16(21-12-22-19)10-17(25-18)13-4-3-9-20-11-13/h3-12H,1-2H3.
What are the key properties of N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine?
N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine has a molecular weight of 348.43 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-N-methyl-6-pyridin-3-ylthieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 44583629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).