2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine

C15H12N4S — CID 83192964

IUPAC2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
SMILESNc1nc(-c2ccc3ncccc3c2)nc2c1CSC2
InChIInChI=1S/C15H12N4S/c16-14-11-7-20-8-13(11)18-15(19-14)10-3-4-12-9(6-10)2-1-5-17-12/h1-6H,7-8H2,(H2,16,18,19)
InChIKeyNCOVWVBYDUAFRH-UHFFFAOYSA-N
MW280.36 g/mol
LogP3.02
Rot. Bonds1

About 2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine

2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine (PubChem CID 83192964) has the molecular formula C15H12N4S and a molecular weight of 280.36 g/mol. Its IUPAC name is 2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
PubChem CID83192964
Molecular FormulaC15H12N4S
Molecular Weight280.36 g/mol
Exact Mass280.08
IUPAC Name2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
SMILESNc1nc(-c2ccc3ncccc3c2)nc2c1CSC2
InChIInChI=1S/C15H12N4S/c16-14-11-7-20-8-13(11)18-15(19-14)10-3-4-12-9(6-10)2-1-5-17-12/h1-6H,7-8H2,(H2,16,18,19)
InChIKeyNCOVWVBYDUAFRH-UHFFFAOYSA-N
XLogP3.02
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.36
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-fluoro-3-methylphenyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83191278
5-iodo-6-propan-2-yl-2-quinolin-6-ylpyrimidin-4-amine
CID 66300911
3-[4-[4,6-di(quinolin-6-yl)-1,3,5-triazin-2-yl]phenyl]quinoline
CID 122426517
6-[4-(4-pyridin-2-ylphenyl)-6-quinolin-6-yl-1,3,5-triazin-2-yl]quinoline
CID 122427591
6-[4-[4,6-bis(4-anthracen-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
CID 154599225
6-[4,6-bis(4-anthracen-2-ylphenyl)pyrimidin-2-yl]quinoline
CID 154599222
(1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 104901602
3-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)thiophen-2-amine
CID 63096652
6-(1H-azirin-2-yl)quinoline
CID 146540612
(3-quinolin-6-yl-1H-1,2,4-triazol-5-yl)methanamine
CID 63097229
3-methyl-6-phenyl-5-quinolin-6-ylpyrazin-2-amine
CID 137430865
5-quinolin-6-ylthiophene-3-carboxylic acid
CID 81224740

Frequently Asked Questions

What is the IUPAC name of 2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The IUPAC name of 2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine (CID 83192964) is 2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine is Nc1nc(-c2ccc3ncccc3c2)nc2c1CSC2.
What is the InChIKey of 2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The InChIKey is NCOVWVBYDUAFRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4S/c16-14-11-7-20-8-13(11)18-15(19-14)10-3-4-12-9(6-10)2-1-5-17-12/h1-6H,7-8H2,(H2,16,18,19).
What are the key properties of 2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine has a molecular weight of 280.36 g/mol, XLogP of 3.02, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinolin-6-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 83192964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).