N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine

C12H15N3S2 — CID 103704155

IUPACN-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCSC1CCC(Nc2ncnc3sccc23)C1
InChIInChI=1S/C12H15N3S2/c1-16-9-3-2-8(6-9)15-11-10-4-5-17-12(10)14-7-13-11/h4-5,7-9H,2-3,6H2,1H3,(H,13,14,15)
InChIKeyKDTPWKRLVDHOSC-UHFFFAOYSA-N
MW265.41 g/mol
LogP3.39
Rot. Bonds3

About N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine

N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 103704155) has the molecular formula C12H15N3S2 and a molecular weight of 265.41 g/mol. Its IUPAC name is N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID103704155
Molecular FormulaC12H15N3S2
Molecular Weight265.41 g/mol
Exact Mass265.07
IUPAC NameN-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCSC1CCC(Nc2ncnc3sccc23)C1
InChIInChI=1S/C12H15N3S2/c1-16-9-3-2-8(6-9)15-11-10-4-5-17-12(10)14-7-13-11/h4-5,7-9H,2-3,6H2,1H3,(H,13,14,15)
InChIKeyKDTPWKRLVDHOSC-UHFFFAOYSA-N
XLogP3.39
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.41
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methylsulfanylcyclopentyl)thieno[3,2-d]pyrimidin-4-amine
CID 113244147
N-cyclobutylthieno[2,3-d]pyrimidin-4-amine
CID 13038304
N-(3-methoxycyclohexyl)thieno[2,3-d]pyrimidin-4-amine
CID 133399288
N-(1-oxothian-4-yl)thieno[2,3-d]pyrimidin-4-amine
CID 104576554
5-(thieno[2,3-d]pyrimidin-4-ylamino)-2,3,3a,4,5,6,7,7a-octahydro-1H-indazole-3-carboxamide
CID 133406930
N-(1-benzylpiperidin-4-yl)thieno[2,3-d]pyrimidin-4-amine;ethane
CID 90925941
N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]thieno[2,3-d]pyrimidin-4-amine
CID 133336179
6-chloro-N-(3-methylsulfanylcyclopentyl)-5-propylpyrimidin-4-amine
CID 114123827
1-N-cyclohexyl-2-N-thieno[2,3-d]pyrimidin-4-ylbenzene-1,2-diamine
CID 68791212
N-(3-azabicyclo[3.1.0]hexan-6-yl)thieno[2,3-d]pyrimidin-4-amine
CID 43599139
N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine
CID 64923589
N-(3-methoxy-2,2-dimethylcyclobutyl)thieno[2,3-d]pyrimidin-4-amine
CID 103742766

Frequently Asked Questions

What is the IUPAC name of N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine (CID 103704155) is N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine is CSC1CCC(Nc2ncnc3sccc23)C1.
What is the InChIKey of N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is KDTPWKRLVDHOSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3S2/c1-16-9-3-2-8(6-9)15-11-10-4-5-17-12(10)14-7-13-11/h4-5,7-9H,2-3,6H2,1H3,(H,13,14,15).
What are the key properties of N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine?
N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 265.41 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 103704155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).