2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine

C15H23N3S — CID 63891532

IUPAC2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
SMILESCCCNc1nc(CC(C)(C)C)nc2sc(C)cc12
InChIInChI=1S/C15H23N3S/c1-6-7-16-13-11-8-10(2)19-14(11)18-12(17-13)9-15(3,4)5/h8H,6-7,9H2,1-5H3,(H,16,17,18)
InChIKeyLZCQZPCSAWJXNF-UHFFFAOYSA-N
MW277.44 g/mol
LogP4.41
Rot. Bonds4

About 2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine

2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 63891532) has the molecular formula C15H23N3S and a molecular weight of 277.44 g/mol. Its IUPAC name is 2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
PubChem CID63891532
Molecular FormulaC15H23N3S
Molecular Weight277.44 g/mol
Exact Mass277.16
IUPAC Name2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
SMILESCCCNc1nc(CC(C)(C)C)nc2sc(C)cc12
InChIInChI=1S/C15H23N3S/c1-6-7-16-13-11-8-10(2)19-14(11)18-12(17-13)9-15(3,4)5/h8H,6-7,9H2,1-5H3,(H,16,17,18)
InChIKeyLZCQZPCSAWJXNF-UHFFFAOYSA-N
XLogP4.41
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.44
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-2-(2-methylpropylsulfanylmethyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 65137018
2-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324046
6-methyl-4-N-(2-methylsulfanylethyl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103328024
3-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
CID 103324486
2-ethyl-6-methyl-N-pent-4-ynylthieno[2,3-d]pyrimidin-4-amine
CID 166120028
6-methyl-2-(4-methylcyclohexyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 63616852
4-N-(2-ethoxyethyl)-6-methyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325198
2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 65405403
2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 116728563
2-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]ethylurea
CID 103329585
2-methyl-2-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
CID 103324837
4-N-(2,2-dimethylpropyl)-2-N-ethyl-6-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325438

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine (CID 63891532) is 2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine is CCCNc1nc(CC(C)(C)C)nc2sc(C)cc12.
What is the InChIKey of 2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is LZCQZPCSAWJXNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3S/c1-6-7-16-13-11-8-10(2)19-14(11)18-12(17-13)9-15(3,4)5/h8H,6-7,9H2,1-5H3,(H,16,17,18).
What are the key properties of 2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 277.44 g/mol, XLogP of 4.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 63891532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).