4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine

C14H21N5S — CID 103329283

IUPAC4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCNc1nc(NC2CCN(C)C(C)C2)c2ccsc2n1
InChIInChI=1S/C14H21N5S/c1-9-8-10(4-6-19(9)3)16-12-11-5-7-20-13(11)18-14(15-2)17-12/h5,7,9-10H,4,6,8H2,1-3H3,(H2,15,16,17,18)
InChIKeyRQQQRXXZRFKESE-UHFFFAOYSA-N
MW291.42 g/mol
LogP2.63
Rot. Bonds3

About 4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine

4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine (PubChem CID 103329283) has the molecular formula C14H21N5S and a molecular weight of 291.42 g/mol. Its IUPAC name is 4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
PubChem CID103329283
Molecular FormulaC14H21N5S
Molecular Weight291.42 g/mol
Exact Mass291.15
IUPAC Name4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCNc1nc(NC2CCN(C)C(C)C2)c2ccsc2n1
InChIInChI=1S/C14H21N5S/c1-9-8-10(4-6-19(9)3)16-12-11-5-7-20-13(11)18-14(15-2)17-12/h5,7,9-10H,4,6,8H2,1-3H3,(H2,15,16,17,18)
InChIKeyRQQQRXXZRFKESE-UHFFFAOYSA-N
XLogP2.63
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine with MolForge

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Related Compounds

4-N-(1,2-dimethylpiperidin-4-yl)-2-N-ethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103329284
4-(3,4-dimethylpiperazin-1-yl)-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103327794
4-(2,4-dimethylpiperidin-1-yl)-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103327188
3,5-dichloro-6-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylpyridine-2,6-diamine
CID 102759271
2-hydrazinyl-N-(3-methoxycyclopentyl)thieno[2,3-d]pyrimidin-4-amine
CID 114118419
4-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324409
N-[(2R,4R)-1,2-dimethylpiperidin-4-yl]-3-[(4-fluorophenyl)methyl]pyrazin-2-amine
CID 156875168
N-[1-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]piperidin-4-yl]acetamide
CID 103329723
[2-[[[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopentyl]methanol
CID 103328659
3-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]cyclobutan-1-ol
CID 103334408
3-[[[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol
CID 106137981
2-[(3,4-dimethylpiperazin-1-yl)methyl]-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 63635807

Frequently Asked Questions

What is the IUPAC name of 4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine (CID 103329283) is 4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine is CNc1nc(NC2CCN(C)C(C)C2)c2ccsc2n1.
What is the InChIKey of 4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is RQQQRXXZRFKESE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5S/c1-9-8-10(4-6-19(9)3)16-12-11-5-7-20-13(11)18-14(15-2)17-12/h5,7,9-10H,4,6,8H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine?
4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 291.42 g/mol, XLogP of 2.63, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(1,2-dimethylpiperidin-4-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 103329283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).