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

C20H18N4OS — CID 26455462

IUPACN-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCOCCNc1nc(-c2cccnc2)nc2sc(-c3ccccc3)cc12
InChIInChI=1S/C20H18N4OS/c1-25-11-10-22-19-16-12-17(14-6-3-2-4-7-14)26-20(16)24-18(23-19)15-8-5-9-21-13-15/h2-9,12-13H,10-11H2,1H3,(H,22,23,24)
InChIKeyVFGKVGHNWRTPFV-UHFFFAOYSA-N
MW362.46 g/mol
LogP4.48
Rot. Bonds6

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

N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 26455462) has the molecular formula C20H18N4OS and a molecular weight of 362.46 g/mol. Its IUPAC name is N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
PubChem CID26455462
Molecular FormulaC20H18N4OS
Molecular Weight362.46 g/mol
Exact Mass362.12
IUPAC NameN-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCOCCNc1nc(-c2cccnc2)nc2sc(-c3ccccc3)cc12
InChIInChI=1S/C20H18N4OS/c1-25-11-10-22-19-16-12-17(14-6-3-2-4-7-14)26-20(16)24-18(23-19)15-8-5-9-21-13-15/h2-9,12-13H,10-11H2,1H3,(H,22,23,24)
InChIKeyVFGKVGHNWRTPFV-UHFFFAOYSA-N
XLogP4.48
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.46
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-(2-methoxyethyl)-6-phenylthieno[2,3-d]pyrimidin-4-amine
CID 93214406
N-(2-phenylethyl)-2-pyridin-3-yl-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-amine
CID 18459868
N-(2,6-diphenylthieno[2,3-d]pyrimidin-4-yl)-N',N'-dimethylbutane-1,4-diamine
CID 166431287
2-[(6-ethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
CID 91965311
N-[(6-imidazol-1-yl-3-pyridinyl)methyl]-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 30039219
1-methoxy-4-[(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]butan-2-ol
CID 133415293
6-(2-methoxyethylamino)-2-pyridin-3-ylpyrimidine-4-carboxylic acid
CID 82170109
N-(2-methoxyethyl)-6-methyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 110430534
4-(azetidin-1-yl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidine
CID 18287230
6-methyl-N-(2-phenylethyl)-2-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine
CID 18460517
N-(3-methoxyphenyl)-6-methyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 71690984
6-methyl-N-[(3-nitrophenyl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 18460094

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine (CID 26455462) is N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine is COCCNc1nc(-c2cccnc2)nc2sc(-c3ccccc3)cc12.
What is the InChIKey of N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is VFGKVGHNWRTPFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4OS/c1-25-11-10-22-19-16-12-17(14-6-3-2-4-7-14)26-20(16)24-18(23-19)15-8-5-9-21-13-15/h2-9,12-13H,10-11H2,1H3,(H,22,23,24).
What are the key properties of N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine?
N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 362.46 g/mol, XLogP of 4.48, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 26455462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).