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

C14H19N3S — CID 64923589

IUPACN-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCC1CCC(Nc2ncnc3sccc23)C1C
InChIInChI=1S/C14H19N3S/c1-3-10-4-5-12(9(10)2)17-13-11-6-7-18-14(11)16-8-15-13/h6-10,12H,3-5H2,1-2H3,(H,15,16,17)
InChIKeyPMRMPEHCXPDLQK-UHFFFAOYSA-N
MW261.39 g/mol
LogP3.93
Rot. Bonds3

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

N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 64923589) has the molecular formula C14H19N3S and a molecular weight of 261.39 g/mol. Its IUPAC name is N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID64923589
Molecular FormulaC14H19N3S
Molecular Weight261.39 g/mol
Exact Mass261.13
IUPAC NameN-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCC1CCC(Nc2ncnc3sccc23)C1C
InChIInChI=1S/C14H19N3S/c1-3-10-4-5-12(9(10)2)17-13-11-6-7-18-14(11)16-8-15-13/h6-10,12H,3-5H2,1-2H3,(H,15,16,17)
InChIKeyPMRMPEHCXPDLQK-UHFFFAOYSA-N
XLogP3.93
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-2-amine
CID 114273439
4-N-(3-ethyl-2-methylcyclopentyl)quinazoline-4,6-diamine
CID 64921714
N-cyclobutylthieno[2,3-d]pyrimidin-4-amine
CID 13038304
N,N-dimethyl-1-[(3S,4R)-4-(thieno[2,3-d]pyrimidin-4-ylamino)oxolan-3-yl]methanesulfonamide
CID 135117350
N-(3-azabicyclo[3.1.0]hexan-6-yl)thieno[2,3-d]pyrimidin-4-amine
CID 43599139
N-(3-methoxy-2,2-dimethylcyclobutyl)thieno[2,3-d]pyrimidin-4-amine
CID 103742766
N-[(1R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]thieno[2,3-d]pyrimidin-4-amine
CID 94181560
N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 43112087
N-(1-oxothian-4-yl)thieno[2,3-d]pyrimidin-4-amine
CID 104576554
N-(2,6-dimethylpiperidin-1-yl)thieno[2,3-d]pyrimidin-4-amine
CID 83026527
N-[(3-methylcyclopentyl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 107413822
N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine
CID 103704155

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine (CID 64923589) is N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine is CCC1CCC(Nc2ncnc3sccc23)C1C.
What is the InChIKey of N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is PMRMPEHCXPDLQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S/c1-3-10-4-5-12(9(10)2)17-13-11-6-7-18-14(11)16-8-15-13/h6-10,12H,3-5H2,1-2H3,(H,15,16,17).
What are the key properties of N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine?
N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 261.39 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 64923589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).