(4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine

C8H12N2S — CID 166915344

IUPAC(4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine
SMILESCC1(C)Cc2scnc2[C@H]1N
InChIInChI=1S/C8H12N2S/c1-8(2)3-5-6(7(8)9)10-4-11-5/h4,7H,3,9H2,1-2H3/t7-/m1/s1
InChIKeyVHDDQIAREGJNBR-SSDOTTSWSA-N
MW168.26 g/mol
LogP1.73
Rot. Bonds

About (4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine

(4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine (PubChem CID 166915344) has the molecular formula C8H12N2S and a molecular weight of 168.26 g/mol. Its IUPAC name is (4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine.

Molecular Properties

Compound Name(4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine
PubChem CID166915344
Molecular FormulaC8H12N2S
Molecular Weight168.26 g/mol
Exact Mass168.07
IUPAC Name(4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine
SMILESCC1(C)Cc2scnc2[C@H]1N
InChIInChI=1S/C8H12N2S/c1-8(2)3-5-6(7(8)9)10-4-11-5/h4,7H,3,9H2,1-2H3/t7-/m1/s1
InChIKeyVHDDQIAREGJNBR-SSDOTTSWSA-N
XLogP1.73
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.26
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine?
The IUPAC name of (4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine (CID 166915344) is (4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine.
What is the SMILES notation for (4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine?
The canonical SMILES for (4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine is CC1(C)Cc2scnc2[C@H]1N.
What is the InChIKey of (4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine?
The InChIKey is VHDDQIAREGJNBR-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H12N2S/c1-8(2)3-5-6(7(8)9)10-4-11-5/h4,7H,3,9H2,1-2H3/t7-/m1/s1.
What are the key properties of (4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine?
(4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine has a molecular weight of 168.26 g/mol, XLogP of 1.73, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-5,5-dimethyl-4,6-dihydrocyclopenta[d][1,3]thiazol-4-amine is sourced from PubChem (CID 166915344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).