5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile

C10H13N3S — CID 91620610

IUPAC5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile
SMILESN#Cc1c(C2CCCCC2)nsc1N
InChIInChI=1S/C10H13N3S/c11-6-8-9(13-14-10(8)12)7-4-2-1-3-5-7/h7H,1-5,12H2
InChIKeyRUQXWFARONXARB-UHFFFAOYSA-N
MW207.30 g/mol
LogP2.64
Rot. Bonds1

About 5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile

5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile (PubChem CID 91620610) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is 5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile.

Molecular Properties

Compound Name5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile
PubChem CID91620610
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC Name5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile
SMILESN#Cc1c(C2CCCCC2)nsc1N
InChIInChI=1S/C10H13N3S/c11-6-8-9(13-14-10(8)12)7-4-2-1-3-5-7/h7H,1-5,12H2
InChIKeyRUQXWFARONXARB-UHFFFAOYSA-N
XLogP2.64
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyclopropyl-5-ethyl-1,2-thiazole-4-carbonitrile
CID 82409870
3-amino-5-(cyclooctylamino)-1,2-thiazole-4-carbonitrile
CID 103382474
3-amino-5-[cyclohexyl(methyl)amino]-1,2-thiazole-4-carbonitrile
CID 103381202
N'-[4-[(4-cyano-3-cyclohexyl-1,2-thiazol-5-yl)oxy]-2,5-dimethylphenyl]-N,N-dimethylmethanimidamide
CID 66691011
2-amino-4-cyclopentyl-6-phenylpyrimidine-5-carbonitrile
CID 166636407
2-amino-6-cyclohexylbenzonitrile
CID 129240388
4-chloro-6-cyclopentylpyrimidine-5-carbonitrile
CID 82395505
5-cyclohexyl-1,2,4-thiadiazol-3-amine
CID 64536605
6-cyclohexyl-2,4-bis(sulfanylidene)-1H-pyrimidine-5-carbonitrile
CID 148794787
N'-[4-[(4-cyano-3-cyclohexyl-1,2-thiazol-5-yl)oxy]-2,5-dimethylphenyl]-N-methyl-N-propan-2-ylmethanimidamide
CID 66691494
2-cyclopentyl-4-cyclopropyl-1,3-thiazol-5-amine
CID 62077032
5-amino-1-[(2-chlorophenyl)methyl]-3-cyclopentylpyrazole-4-carbonitrile
CID 100764251

Frequently Asked Questions

What is the IUPAC name of 5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile?
The IUPAC name of 5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile (CID 91620610) is 5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile.
What is the SMILES notation for 5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile?
The canonical SMILES for 5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile is N#Cc1c(C2CCCCC2)nsc1N.
What is the InChIKey of 5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile?
The InChIKey is RUQXWFARONXARB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c11-6-8-9(13-14-10(8)12)7-4-2-1-3-5-7/h7H,1-5,12H2.
What are the key properties of 5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile?
5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile has a molecular weight of 207.30 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-cyclohexyl-1,2-thiazole-4-carbonitrile is sourced from PubChem (CID 91620610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).