2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine

C15H23N3OS — CID 116728563

IUPAC2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
SMILESCCCNc1nc(C(OC)C(C)C)nc2sc(C)cc12
InChIInChI=1S/C15H23N3OS/c1-6-7-16-13-11-8-10(4)20-15(11)18-14(17-13)12(19-5)9(2)3/h8-9,12H,6-7H2,1-5H3,(H,16,17,18)
InChIKeyFZHKBDSQEVFETH-UHFFFAOYSA-N
MW293.44 g/mol
LogP4.17
Rot. Bonds6

About 2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine

2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 116728563) has the molecular formula C15H23N3OS and a molecular weight of 293.44 g/mol. Its IUPAC name is 2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
PubChem CID116728563
Molecular FormulaC15H23N3OS
Molecular Weight293.44 g/mol
Exact Mass293.16
IUPAC Name2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
SMILESCCCNc1nc(C(OC)C(C)C)nc2sc(C)cc12
InChIInChI=1S/C15H23N3OS/c1-6-7-16-13-11-8-10(4)20-15(11)18-14(17-13)12(19-5)9(2)3/h8-9,12H,6-7H2,1-5H3,(H,16,17,18)
InChIKeyFZHKBDSQEVFETH-UHFFFAOYSA-N
XLogP4.17
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.44
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324046
6-methyl-2-(2-methylpropylsulfanylmethyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 65137018
2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 63891532
6-methyl-4-N-(3-methylbutan-2-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103323240
4-N-(2-ethoxyethyl)-6-methyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325198
2-(1-ethoxy-2,2-dimethylpropyl)-N-ethyl-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 116728558
4-N-(1-methoxypropan-2-yl)-6-methyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324235
2-butan-2-yl-6-ethyl-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 63719456
2-(1-ethoxy-2-methylpropyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 116728435
6-methyl-2-pentan-2-yl-N-(3-phenylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 137432066
3-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
CID 103324486
6-methyl-4-N-(2-methylsulfanylethyl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103328024

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine (CID 116728563) is 2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine is CCCNc1nc(C(OC)C(C)C)nc2sc(C)cc12.
What is the InChIKey of 2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is FZHKBDSQEVFETH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3OS/c1-6-7-16-13-11-8-10(4)20-15(11)18-14(17-13)12(19-5)9(2)3/h8-9,12H,6-7H2,1-5H3,(H,16,17,18).
What are the key properties of 2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 293.44 g/mol, XLogP of 4.17, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxy-2-methylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 116728563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).