4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine

C11H16N4S — CID 103324624

IUPAC4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCCCN(C)c1nc(N)nc2sc(C)cc12
InChIInChI=1S/C11H16N4S/c1-4-5-15(3)9-8-6-7(2)16-10(8)14-11(12)13-9/h6H,4-5H2,1-3H3,(H2,12,13,14)
InChIKeyOGXWOJWDIPTZIW-UHFFFAOYSA-N
MW236.34 g/mol
LogP2.43
Rot. Bonds3

About 4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine

4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine (PubChem CID 103324624) has the molecular formula C11H16N4S and a molecular weight of 236.34 g/mol. Its IUPAC name is 4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
PubChem CID103324624
Molecular FormulaC11H16N4S
Molecular Weight236.34 g/mol
Exact Mass236.11
IUPAC Name4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCCCN(C)c1nc(N)nc2sc(C)cc12
InChIInChI=1S/C11H16N4S/c1-4-5-15(3)9-8-6-7(2)16-10(8)14-11(12)13-9/h6H,4-5H2,1-3H3,(H2,12,13,14)
InChIKeyOGXWOJWDIPTZIW-UHFFFAOYSA-N
XLogP2.43
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-N,4-N-diethyl-6-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103323823
4-N,6-dimethyl-4-N-pentan-2-ylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325150
2-[(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide
CID 103326326
3-[(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)-methylamino]-2-methylpropanenitrile
CID 103326383
6-ethyl-4-N-methyl-4-N-pentylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324668
1-[[(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)-methylamino]methyl]cyclopentan-1-ol
CID 103330744
2-[(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)-methylamino]-N-propan-2-ylacetamide
CID 103326512
2-hydrazinyl-N,6-dimethyl-N-(2-methylsulfonylethyl)thieno[2,3-d]pyrimidin-4-amine
CID 103334584
4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103326280
4-N,6-dimethyl-4-N-(2-methylsulfanylethyl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103329651
2-chloro-N-(2-ethoxyethyl)-N,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 103322184
2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103325641

Frequently Asked Questions

What is the IUPAC name of 4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine (CID 103324624) is 4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine is CCCN(C)c1nc(N)nc2sc(C)cc12.
What is the InChIKey of 4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is OGXWOJWDIPTZIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4S/c1-4-5-15(3)9-8-6-7(2)16-10(8)14-11(12)13-9/h6H,4-5H2,1-3H3,(H2,12,13,14).
What are the key properties of 4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine?
4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 236.34 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 103324624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).