N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine

C9H15N3S — CID 64922824

IUPACN-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine
SMILESCC1CCC(Nc2nncs2)C1C
InChIInChI=1S/C9H15N3S/c1-6-3-4-8(7(6)2)11-9-12-10-5-13-9/h5-8H,3-4H2,1-2H3,(H,11,12)
InChIKeyUASBVYCWNYWBNY-UHFFFAOYSA-N
MW197.31 g/mol
LogP2.38
Rot. Bonds2

About N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine

N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine (PubChem CID 64922824) has the molecular formula C9H15N3S and a molecular weight of 197.31 g/mol. Its IUPAC name is N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound NameN-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine
PubChem CID64922824
Molecular FormulaC9H15N3S
Molecular Weight197.31 g/mol
Exact Mass197.10
IUPAC NameN-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine
SMILESCC1CCC(Nc2nncs2)C1C
InChIInChI=1S/C9H15N3S/c1-6-3-4-8(7(6)2)11-9-12-10-5-13-9/h5-8H,3-4H2,1-2H3,(H,11,12)
InChIKeyUASBVYCWNYWBNY-UHFFFAOYSA-N
XLogP2.38
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.31
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,3-dimethylcyclopentyl)-4-methyl-1,3-thiazol-2-amine
CID 64922035
N-(2,6-dimethylcyclohexyl)-1,3,4-thiadiazol-2-amine
CID 107648553
N-(2-methylthian-3-yl)-1,3,4-thiadiazol-2-amine
CID 107648654
N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine
CID 114695446
N-(2-bicyclo[2.2.2]octanyl)-1,3,4-thiadiazol-2-amine
CID 130863721
N-(1-azabicyclo[3.2.1]octan-4-yl)-1,3,4-thiadiazol-2-amine
CID 107648546
N-(2,3-dimethylcyclohexyl)-1,3-thiazol-2-amine
CID 43080192
N-(5-methylthiolan-3-yl)-1,3,4-thiadiazol-2-amine
CID 107648510
N-(8-tricyclo[5.2.1.02,6]decanyl)-1,3,4-thiadiazol-2-amine
CID 107648835
N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,3,4-thiadiazol-2-amine
CID 107648886
7-chloro-N-(2,3-dimethylcyclopentyl)-1,3-benzothiazol-2-amine
CID 64922438
N-(6-bicyclo[3.2.0]hept-3-enyl)-1,3,4-thiadiazol-2-amine
CID 107648685

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine?
The IUPAC name of N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine (CID 64922824) is N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine?
The canonical SMILES for N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine is CC1CCC(Nc2nncs2)C1C.
What is the InChIKey of N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine?
The InChIKey is UASBVYCWNYWBNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3S/c1-6-3-4-8(7(6)2)11-9-12-10-5-13-9/h5-8H,3-4H2,1-2H3,(H,11,12).
What are the key properties of N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine?
N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine has a molecular weight of 197.31 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclopentyl)-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 64922824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).