2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine

C16H23N3S — CID 10266192

IUPAC2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine
SMILESCCCCc1nc(NC2CCCCC2)c2sccc2n1
InChIInChI=1S/C16H23N3S/c1-2-3-9-14-18-13-10-11-20-15(13)16(19-14)17-12-7-5-4-6-8-12/h10-12H,2-9H2,1H3,(H,17,18,19)
InChIKeyHWQRUIUCCYRXQO-UHFFFAOYSA-N
MW289.45 g/mol
LogP4.78
Rot. Bonds5

About 2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine

2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine (PubChem CID 10266192) has the molecular formula C16H23N3S and a molecular weight of 289.45 g/mol. Its IUPAC name is 2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine
PubChem CID10266192
Molecular FormulaC16H23N3S
Molecular Weight289.45 g/mol
Exact Mass289.16
IUPAC Name2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine
SMILESCCCCc1nc(NC2CCCCC2)c2sccc2n1
InChIInChI=1S/C16H23N3S/c1-2-3-9-14-18-13-10-11-20-15(13)16(19-14)17-12-7-5-4-6-8-12/h10-12H,2-9H2,1H3,(H,17,18,19)
InChIKeyHWQRUIUCCYRXQO-UHFFFAOYSA-N
XLogP4.78
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.45
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(Piperazin-1-yl)thieno[3,2-d]pyrimidine
CID 2760428
N-(3-bromophenyl)thieno[3,2-d]pyrimidin-4-amine
CID 5328383
2-Ethyl-4-thiophen-2-ylthieno[3,2-d]pyrimidine
CID 44449258
N-methylthieno[3,2-d]pyrimidin-4-amine
CID 23273491
3-[methyl-[2-[methyl-(1-Methylpiperidin-4-Yl)amino]thieno[3,2-D]pyrimidin-4-Yl]amino]propanenitrile
CID 75277375
3-[[2-[3-(Dimethylamino)propyl-methyl-amino]thieno[3,2-d]pyrimidin-4-yl]-methyl-amino]propanenitrile
CID 146027019
3-[Methyl-[2-[methyl(piperidin-4-yl)amino]thieno[3,2-d]pyrimidin-4-yl]amino]propanenitrile
CID 146027021
3-[[2-[(1-Ethylpiperidin-4-yl)-methyl-amino]thieno[3,2-d]pyrimidin-4-yl]-methyl-amino]propanenitrile
CID 146027022
N-(1-benzylpiperidin-4-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 2808818
N4-[3-(dimethylamino)propyl]-N2-methyl-6-phenyl-thieno[3,2-d]pyrimidine-2,4-diamine
CID 76310732
4-[4-[3-(Dimethylamino)propylamino]-2-(methylamino)thieno[3,2-d]pyrimidin-6-yl]benzonitrile
CID 76310735
3-[4-[3-(Dimethylamino)propylamino]-2-(methylamino)thieno[3,2-d]pyrimidin-6-yl]benzonitrile
CID 76314357

Frequently Asked Questions

What is the IUPAC name of 2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of 2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine (CID 10266192) is 2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine is CCCCc1nc(NC2CCCCC2)c2sccc2n1.
What is the InChIKey of 2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine?
The InChIKey is HWQRUIUCCYRXQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3S/c1-2-3-9-14-18-13-10-11-20-15(13)16(19-14)17-12-7-5-4-6-8-12/h10-12H,2-9H2,1H3,(H,17,18,19).
What are the key properties of 2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine?
2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine has a molecular weight of 289.45 g/mol, XLogP of 4.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-N-cyclohexylthieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 10266192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).