3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine

C15H23N3S — CID 63202380

IUPAC3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine
SMILESCCCNC(Cc1ncnc2ccsc12)C(C)(C)C
InChIInChI=1S/C15H23N3S/c1-5-7-16-13(15(2,3)4)9-12-14-11(6-8-19-14)17-10-18-12/h6,8,10,13,16H,5,7,9H2,1-4H3
InChIKeyPCUZVSKTQRFHHV-UHFFFAOYSA-N
MW277.44 g/mol
LogP3.65
Rot. Bonds5

About 3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine

3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine (PubChem CID 63202380) has the molecular formula C15H23N3S and a molecular weight of 277.44 g/mol. Its IUPAC name is 3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine.

Molecular Properties

Compound Name3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine
PubChem CID63202380
Molecular FormulaC15H23N3S
Molecular Weight277.44 g/mol
Exact Mass277.16
IUPAC Name3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine
SMILESCCCNC(Cc1ncnc2ccsc12)C(C)(C)C
InChIInChI=1S/C15H23N3S/c1-5-7-16-13(15(2,3)4)9-12-14-11(6-8-19-14)17-10-18-12/h6,8,10,13,16H,5,7,9H2,1-4H3
InChIKeyPCUZVSKTQRFHHV-UHFFFAOYSA-N
XLogP3.65
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.44
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-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

3-methyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine
CID 63201763
4-butylthieno[3,2-d]pyrimidine
CID 178009105
1-(6-ethylpyrimidin-4-yl)-3,3-dimethyl-N-propylbutan-2-amine
CID 63202291
3,3-dimethyl-1-(3-methylquinoxalin-2-yl)-N-propylbutan-2-amine
CID 63202147
N'-propan-2-yl-N-thieno[3,2-d]pyrimidin-4-ylethane-1,2-diamine
CID 62663575
N-pentan-2-ylthieno[3,2-d]pyrimidin-4-amine
CID 43236191
3,3-dimethyl-1-(6-propan-2-yloxypyrimidin-4-yl)-N-propylbutan-2-amine
CID 66331216
1-(4-fluorophenyl)-3,3-dimethyl-N-propylbutan-2-amine
CID 60820444
N',N'-diethyl-N-thieno[3,2-d]pyrimidin-4-ylethane-1,2-diamine
CID 43236110
1-(3-chlorothiophen-2-yl)-4,4-dimethyl-N-propylpentan-3-amine
CID 107360809
N-(5-methylhexyl)thieno[3,2-d]pyrimidin-4-amine
CID 79003294
2-(thieno[3,2-d]pyrimidin-4-ylamino)ethanethiol
CID 58265115

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine?
The IUPAC name of 3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine (CID 63202380) is 3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine.
What is the SMILES notation for 3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine?
The canonical SMILES for 3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine is CCCNC(Cc1ncnc2ccsc12)C(C)(C)C.
What is the InChIKey of 3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine?
The InChIKey is PCUZVSKTQRFHHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3S/c1-5-7-16-13(15(2,3)4)9-12-14-11(6-8-19-14)17-10-18-12/h6,8,10,13,16H,5,7,9H2,1-4H3.
What are the key properties of 3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine?
3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine has a molecular weight of 277.44 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-N-propyl-1-thieno[3,2-d]pyrimidin-4-ylbutan-2-amine is sourced from PubChem (CID 63202380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).