2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine

C15H21N3OS — CID 116775498

IUPAC2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCOC1(c2nc(N)c3cc(C)sc3n2)CCCC(C)C1
InChIInChI=1S/C15H21N3OS/c1-9-5-4-6-15(8-9,19-3)14-17-12(16)11-7-10(2)20-13(11)18-14/h7,9H,4-6,8H2,1-3H3,(H2,16,17,18)
InChIKeyACHRQNOIDRZPJT-UHFFFAOYSA-N
MW291.42 g/mol
LogP3.63
Rot. Bonds2

About 2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine

2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 116775498) has the molecular formula C15H21N3OS and a molecular weight of 291.42 g/mol. Its IUPAC name is 2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
PubChem CID116775498
Molecular FormulaC15H21N3OS
Molecular Weight291.42 g/mol
Exact Mass291.14
IUPAC Name2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCOC1(c2nc(N)c3cc(C)sc3n2)CCCC(C)C1
InChIInChI=1S/C15H21N3OS/c1-9-5-4-6-15(8-9,19-3)14-17-12(16)11-7-10(2)20-13(11)18-14/h7,9H,4-6,8H2,1-3H3,(H2,16,17,18)
InChIKeyACHRQNOIDRZPJT-UHFFFAOYSA-N
XLogP3.63
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-methoxy-3-methylcyclohexyl)-6-methyl-5-propan-2-ylpyrimidin-4-amine
CID 116776210
2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine
CID 116782598
4-chloro-6-cyclopropyl-2-(1-methoxy-3-methylcyclohexyl)pyrimidine
CID 116745914
[2-(1-methoxy-3-methylcyclohexyl)-4-methylpyrimidin-5-yl]methanamine
CID 114205933
2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine
CID 116782578
2-(1-methoxycyclobutyl)thieno[2,3-d]pyrimidin-4-amine
CID 116728373
6-methyl-2-(2-methylcyclopropyl)thieno[2,3-d]pyrimidin-4-amine
CID 65420873
1-[2-(1-methoxy-3-methylcyclohexyl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 116774230
2-(1-ethoxycyclopentyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine
CID 116775464
3-[3-(1-methoxy-3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]aniline
CID 116742709
3-methyl-1-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexane-1-carboxylic acid
CID 63617216
[2-(1-methoxy-3-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 116777478

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine (CID 116775498) is 2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine is COC1(c2nc(N)c3cc(C)sc3n2)CCCC(C)C1.
What is the InChIKey of 2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is ACHRQNOIDRZPJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3OS/c1-9-5-4-6-15(8-9,19-3)14-17-12(16)11-7-10(2)20-13(11)18-14/h7,9H,4-6,8H2,1-3H3,(H2,16,17,18).
What are the key properties of 2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 291.42 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 116775498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).