N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine

C15H16N4OS — CID 133408919

IUPACN-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCCOc1ncccc1CNc1ncnc2sc(C)cc12
InChIInChI=1S/C15H16N4OS/c1-3-20-14-11(5-4-6-16-14)8-17-13-12-7-10(2)21-15(12)19-9-18-13/h4-7,9H,3,8H2,1-2H3,(H,17,18,19)
InChIKeyYEJGINUPLQJEJY-UHFFFAOYSA-N
MW300.39 g/mol
LogP3.41
Rot. Bonds5

About N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine

N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 133408919) has the molecular formula C15H16N4OS and a molecular weight of 300.39 g/mol. Its IUPAC name is N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
PubChem CID133408919
Molecular FormulaC15H16N4OS
Molecular Weight300.39 g/mol
Exact Mass300.10
IUPAC NameN-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCCOc1ncccc1CNc1ncnc2sc(C)cc12
InChIInChI=1S/C15H16N4OS/c1-3-20-14-11(5-4-6-16-14)8-17-13-12-7-10(2)21-15(12)19-9-18-13/h4-7,9H,3,8H2,1-2H3,(H,17,18,19)
InChIKeyYEJGINUPLQJEJY-UHFFFAOYSA-N
XLogP3.41
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.39
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2-ethoxy-3-pyridinyl)methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine
CID 30826162
6-methyl-N-[(2,4,5-trimethoxyphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 133407869
6-methyl-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]thieno[2,3-d]pyrimidin-4-amine
CID 133407915
6-methyl-N-[(2-methylpyrazol-3-yl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 133409041
N-[(2-ethoxy-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62290832
2-methyl-N-[4-[[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]methyl]phenyl]propanamide
CID 133408641
3-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-N-(pyridin-2-ylmethyl)propanamide
CID 75509069
6-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 133409360
N-[2-(4-methoxyphenoxy)ethyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 133408034
5-[[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]methyl]pyridine-2-carboxylic acid
CID 81088363
N-[2-(chloromethyl)-2-ethylbutyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 106252993
2-[2-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethoxy]ethanol
CID 28850882

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine (CID 133408919) is N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine is CCOc1ncccc1CNc1ncnc2sc(C)cc12.
What is the InChIKey of N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is YEJGINUPLQJEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4OS/c1-3-20-14-11(5-4-6-16-14)8-17-13-12-7-10(2)21-15(12)19-9-18-13/h4-7,9H,3,8H2,1-2H3,(H,17,18,19).
What are the key properties of N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine?
N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 300.39 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethoxy-3-pyridinyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 133408919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).