2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine

C14H19N3OS — CID 144752457

IUPAC2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine
SMILESNCCc1cc2c(OC3CCCCC3)ncnc2s1
InChIInChI=1S/C14H19N3OS/c15-7-6-11-8-12-13(16-9-17-14(12)19-11)18-10-4-2-1-3-5-10/h8-10H,1-7,15H2
InChIKeyHFWJLHMTAQBIDK-UHFFFAOYSA-N
MW277.39 g/mol
LogP2.90
Rot. Bonds4

About 2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine

2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine (PubChem CID 144752457) has the molecular formula C14H19N3OS and a molecular weight of 277.39 g/mol. Its IUPAC name is 2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine.

Molecular Properties

Compound Name2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine
PubChem CID144752457
Molecular FormulaC14H19N3OS
Molecular Weight277.39 g/mol
Exact Mass277.12
IUPAC Name2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine
SMILESNCCc1cc2c(OC3CCCCC3)ncnc2s1
InChIInChI=1S/C14H19N3OS/c15-7-6-11-8-12-13(16-9-17-14(12)19-11)18-10-4-2-1-3-5-10/h8-10H,1-7,15H2
InChIKeyHFWJLHMTAQBIDK-UHFFFAOYSA-N
XLogP2.90
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(6-methylthieno[2,3-d]pyrimidin-4-yl)oxycyclohexan-1-amine
CID 79465530
3-[4-(cyclooctylamino)thieno[2,3-d]pyrimidin-6-yl]propan-1-ol
CID 139931150
6-ethyl-4-pyrrolidin-3-yloxythieno[2,3-d]pyrimidine
CID 62348094
4-(6-methylthieno[2,3-d]pyrimidin-4-yl)oxycyclohexan-1-amine
CID 63617901
N'-cyclopentyl-N'-(6-ethylthieno[2,3-d]pyrimidin-4-yl)ethane-1,2-diamine
CID 62588172
1-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)oxymethyl]cyclohexan-1-amine
CID 64572973
6-ethyl-N-(3-methoxycyclohexyl)thieno[2,3-d]pyrimidin-4-amine
CID 133399232
N-cycloheptyl-6-[(oxetan-3-ylmethylamino)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 101442998
2-(4-cycloheptyloxy-3,5-difluorophenyl)ethanamine
CID 82930013
2-(12-cyclohexyloxy-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-3-yl)ethanol
CID 77412612
[6-ethyl-4-(3-methylcyclohexyl)oxythieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336034
12-cyclohexyloxy-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraene;methanamine;propanamide;hydroiodide
CID 144752336

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine?
The IUPAC name of 2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine (CID 144752457) is 2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine.
What is the SMILES notation for 2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine?
The canonical SMILES for 2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine is NCCc1cc2c(OC3CCCCC3)ncnc2s1.
What is the InChIKey of 2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine?
The InChIKey is HFWJLHMTAQBIDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3OS/c15-7-6-11-8-12-13(16-9-17-14(12)19-11)18-10-4-2-1-3-5-10/h8-10H,1-7,15H2.
What are the key properties of 2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine?
2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine has a molecular weight of 277.39 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclohexyloxythieno[2,3-d]pyrimidin-6-yl)ethanamine is sourced from PubChem (CID 144752457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).