N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine

C14H15N3S2 — CID 2579357

IUPACN,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1sc2ncnc(N(C)Cc3cccs3)c2c1C
InChIInChI=1S/C14H15N3S2/c1-9-10(2)19-14-12(9)13(15-8-16-14)17(3)7-11-5-4-6-18-11/h4-6,8H,7H2,1-3H3
InChIKeyDLEKRKSWXMSNLB-UHFFFAOYSA-N
MW289.43 g/mol
LogP4.01
Rot. Bonds3

About N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine

N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 2579357) has the molecular formula C14H15N3S2 and a molecular weight of 289.43 g/mol. Its IUPAC name is N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID2579357
Molecular FormulaC14H15N3S2
Molecular Weight289.43 g/mol
Exact Mass289.07
IUPAC NameN,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1sc2ncnc(N(C)Cc3cccs3)c2c1C
InChIInChI=1S/C14H15N3S2/c1-9-10(2)19-14-12(9)13(15-8-16-14)17(3)7-11-5-4-6-18-11/h4-6,8H,7H2,1-3H3
InChIKeyDLEKRKSWXMSNLB-UHFFFAOYSA-N
XLogP4.01
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.43
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine (CID 2579357) is N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine is Cc1sc2ncnc(N(C)Cc3cccs3)c2c1C.
What is the InChIKey of N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is DLEKRKSWXMSNLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3S2/c1-9-10(2)19-14-12(9)13(15-8-16-14)17(3)7-11-5-4-6-18-11/h4-6,8H,7H2,1-3H3.
What are the key properties of N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 289.43 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,5,6-trimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 2579357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).