N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine

C9H14N2S — CID 65046751

IUPACN-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine
SMILESCCNc1nc2c(s1)CCC2C
InChIInChI=1S/C9H14N2S/c1-3-10-9-11-8-6(2)4-5-7(8)12-9/h6H,3-5H2,1-2H3,(H,10,11)
InChIKeyWHGSQAYPSGSLDM-UHFFFAOYSA-N
MW182.29 g/mol
LogP2.62
Rot. Bonds2

About N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine

N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine (PubChem CID 65046751) has the molecular formula C9H14N2S and a molecular weight of 182.29 g/mol. Its IUPAC name is N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine
PubChem CID65046751
Molecular FormulaC9H14N2S
Molecular Weight182.29 g/mol
Exact Mass182.09
IUPAC NameN-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine
SMILESCCNc1nc2c(s1)CCC2C
InChIInChI=1S/C9H14N2S/c1-3-10-9-11-8-6(2)4-5-7(8)12-9/h6H,3-5H2,1-2H3,(H,10,11)
InChIKeyWHGSQAYPSGSLDM-UHFFFAOYSA-N
XLogP2.62
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine?
The IUPAC name of N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine (CID 65046751) is N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine.
What is the SMILES notation for N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine?
The canonical SMILES for N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine is CCNc1nc2c(s1)CCC2C.
What is the InChIKey of N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine?
The InChIKey is WHGSQAYPSGSLDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2S/c1-3-10-9-11-8-6(2)4-5-7(8)12-9/h6H,3-5H2,1-2H3,(H,10,11).
What are the key properties of N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine?
N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine has a molecular weight of 182.29 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine is sourced from PubChem (CID 65046751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).