N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine

C17H19N3S — CID 63615625

IUPACN,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCNc1nc(-c2ccccc2C)nc2sc(CC)cc12
InChIInChI=1S/C17H19N3S/c1-4-12-10-14-15(18-5-2)19-16(20-17(14)21-12)13-9-7-6-8-11(13)3/h6-10H,4-5H2,1-3H3,(H,18,19,20)
InChIKeyRVSKXXKLCFSGGW-UHFFFAOYSA-N
MW297.43 g/mol
LogP4.66
Rot. Bonds4

About N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine

N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 63615625) has the molecular formula C17H19N3S and a molecular weight of 297.43 g/mol. Its IUPAC name is N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID63615625
Molecular FormulaC17H19N3S
Molecular Weight297.43 g/mol
Exact Mass297.13
IUPAC NameN,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCNc1nc(-c2ccccc2C)nc2sc(CC)cc12
InChIInChI=1S/C17H19N3S/c1-4-12-10-14-15(18-5-2)19-16(20-17(14)21-12)13-9-7-6-8-11(13)3/h6-10H,4-5H2,1-3H3,(H,18,19,20)
InChIKeyRVSKXXKLCFSGGW-UHFFFAOYSA-N
XLogP4.66
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.43
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,6-diethyl-2-(3-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 63615787
N,6-diethyl-2-thiophen-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 63616126
6-ethyl-2-(4-fluoro-2-methylphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 81274014
N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 55248382
4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324155
N,5-diethyl-6-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 62191964
N,6-diethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335153
5-bromo-N,6-diethyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 66299061
5-bromo-N-ethyl-6-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 66306280
2-(2,6-difluorophenyl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 79516498
N-benzyl-6-ethyl-2-(1,2-oxazol-5-yl)thieno[2,3-d]pyrimidin-4-amine
CID 18460206
6-ethyl-N-methyl-2-(6-methyl-2-pyridinyl)thieno[2,3-d]pyrimidin-4-amine
CID 63616457

Frequently Asked Questions

What is the IUPAC name of N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine (CID 63615625) is N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine is CCNc1nc(-c2ccccc2C)nc2sc(CC)cc12.
What is the InChIKey of N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is RVSKXXKLCFSGGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3S/c1-4-12-10-14-15(18-5-2)19-16(20-17(14)21-12)13-9-7-6-8-11(13)3/h6-10H,4-5H2,1-3H3,(H,18,19,20).
What are the key properties of N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 297.43 g/mol, XLogP of 4.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-diethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 63615625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).