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

C8H12N2S — CID 65046749

IUPACN,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine
SMILESCNc1nc2c(s1)CCC2C
InChIInChI=1S/C8H12N2S/c1-5-3-4-6-7(5)10-8(9-2)11-6/h5H,3-4H2,1-2H3,(H,9,10)
InChIKeyBXNDYBNOJVOTMF-UHFFFAOYSA-N
MW168.26 g/mol
LogP2.23
Rot. Bonds1

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

N,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine (PubChem CID 65046749) has the molecular formula C8H12N2S and a molecular weight of 168.26 g/mol. Its IUPAC name is N,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine.

Molecular Properties

Compound NameN,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine
PubChem CID65046749
Molecular FormulaC8H12N2S
Molecular Weight168.26 g/mol
Exact Mass168.07
IUPAC NameN,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine
SMILESCNc1nc2c(s1)CCC2C
InChIInChI=1S/C8H12N2S/c1-5-3-4-6-7(5)10-8(9-2)11-6/h5H,3-4H2,1-2H3,(H,9,10)
InChIKeyBXNDYBNOJVOTMF-UHFFFAOYSA-N
XLogP2.23
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.26
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine?
The IUPAC name of N,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine (CID 65046749) is N,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine.
What is the SMILES notation for N,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine?
The canonical SMILES for N,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine is CNc1nc2c(s1)CCC2C.
What is the InChIKey of N,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine?
The InChIKey is BXNDYBNOJVOTMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2S/c1-5-3-4-6-7(5)10-8(9-2)11-6/h5H,3-4H2,1-2H3,(H,9,10).
What are the key properties of N,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine?
N,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine has a molecular weight of 168.26 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine is sourced from PubChem (CID 65046749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).