6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine

C16H25N3OS — CID 103331306

IUPAC6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine
SMILESCCCNc1nc(OC(C)(C)CC)c2cc(CC)sc2n1
InChIInChI=1S/C16H25N3OS/c1-6-9-17-15-18-13(20-16(4,5)8-3)12-10-11(7-2)21-14(12)19-15/h10H,6-9H2,1-5H3,(H,17,18,19)
InChIKeyDLXRKGBEESNMBU-UHFFFAOYSA-N
MW307.46 g/mol
LogP4.64
Rot. Bonds7

About 6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine

6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103331306) has the molecular formula C16H25N3OS and a molecular weight of 307.46 g/mol. Its IUPAC name is 6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103331306
Molecular FormulaC16H25N3OS
Molecular Weight307.46 g/mol
Exact Mass307.17
IUPAC Name6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine
SMILESCCCNc1nc(OC(C)(C)CC)c2cc(CC)sc2n1
InChIInChI=1S/C16H25N3OS/c1-6-9-17-15-18-13(20-16(4,5)8-3)12-10-11(7-2)21-14(12)19-15/h10H,6-9H2,1-5H3,(H,17,18,19)
InChIKeyDLXRKGBEESNMBU-UHFFFAOYSA-N
XLogP4.64
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.46
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethyl-N-propyl-4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-amine
CID 103331247
[6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336021
4-N,4-N,6-triethyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103323820
6-ethyl-2-N-methyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324044
4-(2,2-dimethylhydrazinyl)-6-ethyl-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 103329501
6-ethyl-4-N-pentan-2-yl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324208
4-N-(2,2-dimethylbutyl)-2-N,6-diethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103466672
4-[(E)-but-2-enoxy]-N,6-diethylthieno[2,3-d]pyrimidin-2-amine
CID 103332325
4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324155
N-(2-ethoxy-2-methylpropyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335867
N,6-diethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335153
2-[2-[[6-ethyl-2-(ethylamino)thieno[2,3-d]pyrimidin-4-yl]amino]ethoxy]ethanol
CID 103327253

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine (CID 103331306) is 6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine is CCCNc1nc(OC(C)(C)CC)c2cc(CC)sc2n1.
What is the InChIKey of 6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is DLXRKGBEESNMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3OS/c1-6-9-17-15-18-13(20-16(4,5)8-3)12-10-11(7-2)21-14(12)19-15/h10H,6-9H2,1-5H3,(H,17,18,19).
What are the key properties of 6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine?
6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 307.46 g/mol, XLogP of 4.64, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103331306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).