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

C14H13N3S2 — CID 56799553

IUPACN-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESc1nc(N(Cc2ccsc2)C2CC2)c2ccsc2n1
InChIInChI=1S/C14H13N3S2/c1-2-11(1)17(7-10-3-5-18-8-10)13-12-4-6-19-14(12)16-9-15-13/h3-6,8-9,11H,1-2,7H2
InChIKeyDIAZPNIODVTHJS-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.92
Rot. Bonds4

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

N-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 56799553) has the molecular formula C14H13N3S2 and a molecular weight of 287.41 g/mol. Its IUPAC name is N-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID56799553
Molecular FormulaC14H13N3S2
Molecular Weight287.41 g/mol
Exact Mass287.06
IUPAC NameN-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESc1nc(N(Cc2ccsc2)C2CC2)c2ccsc2n1
InChIInChI=1S/C14H13N3S2/c1-2-11(1)17(7-10-3-5-18-8-10)13-12-4-6-19-14(12)16-9-15-13/h3-6,8-9,11H,1-2,7H2
InChIKeyDIAZPNIODVTHJS-UHFFFAOYSA-N
XLogP3.92
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-cyclopropyl-4-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103325687
2-[cyclohexyl(thieno[2,3-d]pyrimidin-4-yl)amino]ethanol
CID 54999057
2-[cyclopentyl(thieno[2,3-d]pyrimidin-4-yl)amino]acetic acid
CID 60840198
5-(bromomethyl)-N-cyclopropyl-3-methyl-N-(thiophen-3-ylmethyl)pyridin-2-amine
CID 107081264
N-cyclopropyl-6-hydrazinyl-N-(thiophen-3-ylmethyl)pyrimidin-4-amine
CID 80896481
N-cyclopropyl-5-(methylaminomethyl)-N-(thiophen-3-ylmethyl)pyrazin-2-amine
CID 107379600
2-N-cyclopropyl-4-methyl-2-N-(thiophen-3-ylmethyl)pyridine-2,5-diamine
CID 79173041
4-(aminomethyl)-3-chloro-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridin-2-amine
CID 107055267
8-N-cyclopropyl-8-N-(thiophen-3-ylmethyl)isoquinoline-5,8-diamine
CID 103137550
6-chloro-N-cyclopropyl-2,5-dimethyl-N-(thiophen-3-ylmethyl)pyrimidin-4-amine
CID 63729453
6-N-cyclopropyl-6-N-(thiophen-3-ylmethyl)quinoline-5,6-diamine
CID 61433524
N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine
CID 62754444

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine (CID 56799553) is N-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine is c1nc(N(Cc2ccsc2)C2CC2)c2ccsc2n1.
What is the InChIKey of N-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is DIAZPNIODVTHJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3S2/c1-2-11(1)17(7-10-3-5-18-8-10)13-12-4-6-19-14(12)16-9-15-13/h3-6,8-9,11H,1-2,7H2.
What are the key properties of N-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
N-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 287.41 g/mol, XLogP of 3.92, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(thiophen-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 56799553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).