N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine

C15H15N3S — CID 55162208

IUPACN-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine
SMILESCNC(Cc1ncnc2sccc12)c1ccccc1
InChIInChI=1S/C15H15N3S/c1-16-13(11-5-3-2-4-6-11)9-14-12-7-8-19-15(12)18-10-17-14/h2-8,10,13,16H,9H2,1H3
InChIKeyWBPULJRBRSQNOS-UHFFFAOYSA-N
MW269.37 g/mol
LogP3.19
Rot. Bonds4

About N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine

N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine (PubChem CID 55162208) has the molecular formula C15H15N3S and a molecular weight of 269.37 g/mol. Its IUPAC name is N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine.

Molecular Properties

Compound NameN-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine
PubChem CID55162208
Molecular FormulaC15H15N3S
Molecular Weight269.37 g/mol
Exact Mass269.10
IUPAC NameN-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine
SMILESCNC(Cc1ncnc2sccc12)c1ccccc1
InChIInChI=1S/C15H15N3S/c1-16-13(11-5-3-2-4-6-11)9-14-12-7-8-19-15(12)18-10-17-14/h2-8,10,13,16H,9H2,1H3
InChIKeyWBPULJRBRSQNOS-UHFFFAOYSA-N
XLogP3.19
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-1-phenylethanamine
CID 63617235
N-methyl-1-thieno[2,3-d]pyrimidin-4-ylpropan-2-amine
CID 63199538
1-thieno[2,3-d]pyrimidin-4-ylpropan-2-amine
CID 63196630
1-thieno[2,3-d]pyrimidin-4-ylbutan-2-amine
CID 63197779
4-(2-chloro-3,3-dimethylbutyl)thieno[2,3-d]pyrimidine
CID 63202692
N-[(1R)-1-phenyl-2-pyrrolidin-1-ylethyl]thieno[2,3-d]pyrimidin-4-amine
CID 36725383
1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine
CID 63352857
N-(3-phenylbutyl)thieno[2,3-d]pyrimidin-4-amine
CID 62402452
N-[(1S)-1,2-diphenylethyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide
CID 9389594
2-(5-chloro-3-fluoro-2-pyridinyl)-N-methyl-1-phenylethanamine
CID 79734364
2,2-diphenyl-N-thieno[2,3-d]pyrimidin-4-ylacetamide
CID 7615397
2-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methyl-1-phenylethanamine
CID 65168981

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine?
The IUPAC name of N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine (CID 55162208) is N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine.
What is the SMILES notation for N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine?
The canonical SMILES for N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine is CNC(Cc1ncnc2sccc12)c1ccccc1.
What is the InChIKey of N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine?
The InChIKey is WBPULJRBRSQNOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3S/c1-16-13(11-5-3-2-4-6-11)9-14-12-7-8-19-15(12)18-10-17-14/h2-8,10,13,16H,9H2,1H3.
What are the key properties of N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine?
N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine has a molecular weight of 269.37 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine is sourced from PubChem (CID 55162208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).