2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

C10H15N3S — CID 164655249

IUPAC2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCSCCc1nc(N)c2c(n1)CCC2
InChIInChI=1S/C10H15N3S/c1-14-6-5-9-12-8-4-2-3-7(8)10(11)13-9/h2-6H2,1H3,(H2,11,12,13)
InChIKeyWLEPGKVMDMIMMM-UHFFFAOYSA-N
MW209.32 g/mol
LogP1.45
Rot. Bonds3

About 2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 164655249) has the molecular formula C10H15N3S and a molecular weight of 209.32 g/mol. Its IUPAC name is 2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID164655249
Molecular FormulaC10H15N3S
Molecular Weight209.32 g/mol
Exact Mass209.10
IUPAC Name2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCSCCc1nc(N)c2c(n1)CCC2
InChIInChI=1S/C10H15N3S/c1-14-6-5-9-12-8-4-2-3-7(8)10(11)13-9/h2-6H2,1H3,(H2,11,12,13)
InChIKeyWLEPGKVMDMIMMM-UHFFFAOYSA-N
XLogP1.45
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.32
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethoxyethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 106815258
2-[2-(methylamino)ethyl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 105476582
3-(4-amino-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)propanoic acid
CID 105460225
2-(tert-butylsulfanylmethyl)-5,6,7,8-tetrahydroquinazolin-4-amine
CID 65137814
5-(4-amino-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)pentanoic acid
CID 134116459
2-(2-aminopropyl)-5,6,7,8-tetrahydroquinazolin-4-amine
CID 105459542
2-(2-aminopropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 105476583
2-[(2-methylphenyl)methyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 62190657
2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethanamine;dihydrochloride
CID 75530624
2-[2-(methylamino)propyl]-5,6,7,8-tetrahydroquinazolin-4-amine
CID 105476585
2-(butan-2-ylsulfanylmethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 65140979
2-[2-(2,2-difluoroethoxy)ethyl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 103150346

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of 2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 164655249) is 2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for 2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for 2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is CSCCc1nc(N)c2c(n1)CCC2.
What is the InChIKey of 2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is WLEPGKVMDMIMMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3S/c1-14-6-5-9-12-8-4-2-3-7(8)10(11)13-9/h2-6H2,1H3,(H2,11,12,13).
What are the key properties of 2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 209.32 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylsulfanylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 164655249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).