1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone

C10H14N2OS — CID 116587134

IUPAC1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone
SMILESNC1CCC(C(=O)Cc2nccs2)C1
InChIInChI=1S/C10H14N2OS/c11-8-2-1-7(5-8)9(13)6-10-12-3-4-14-10/h3-4,7-8H,1-2,5-6,11H2
InChIKeyYEZCPOQKXTWFEL-UHFFFAOYSA-N
MW210.30 g/mol
LogP1.38
Rot. Bonds3

About 1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone

1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone (PubChem CID 116587134) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is 1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone.

Molecular Properties

Compound Name1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone
PubChem CID116587134
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC Name1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone
SMILESNC1CCC(C(=O)Cc2nccs2)C1
InChIInChI=1S/C10H14N2OS/c11-8-2-1-7(5-8)9(13)6-10-12-3-4-14-10/h3-4,7-8H,1-2,5-6,11H2
InChIKeyYEZCPOQKXTWFEL-UHFFFAOYSA-N
XLogP1.38
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-aminocyclohexyl)-2-(1,3-thiazol-2-yl)ethanone
CID 116579837
1-(3-aminocyclopentyl)-2-pyridin-4-ylethanone
CID 116587341
3-amino-N-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexane-1-carboxamide
CID 119891599
1-[2-(aminomethyl)cyclopentyl]-2-(1,3-thiazol-2-yl)ethanone
CID 116584260
1-cyclopropyl-4-(1,3-thiazol-2-yl)butan-1-one
CID 79824416
1-piperidin-2-yl-2-(1,3-thiazol-2-yl)ethanone
CID 116547771
1-(3-aminocyclopentyl)-2-(4-iodophenyl)ethanone
CID 116587269
3-N-(1,3-thiazol-2-ylmethyl)cyclopentane-1,3-diamine
CID 79462024
4-methyl-3-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine
CID 165491533
1-(3-aminocyclopentyl)-2-(5-bromo-3-pyridinyl)ethanone
CID 116587348
1-(1,4-dimethylpiperazin-2-yl)-2-(1,3-thiazol-2-yl)ethanone
CID 79824120
1-(1,3-thiazol-2-yl)but-3-en-2-one
CID 103453622

Frequently Asked Questions

What is the IUPAC name of 1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone?
The IUPAC name of 1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone (CID 116587134) is 1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone.
What is the SMILES notation for 1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone?
The canonical SMILES for 1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone is NC1CCC(C(=O)Cc2nccs2)C1.
What is the InChIKey of 1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone?
The InChIKey is YEZCPOQKXTWFEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c11-8-2-1-7(5-8)9(13)6-10-12-3-4-14-10/h3-4,7-8H,1-2,5-6,11H2.
What are the key properties of 1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone?
1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone has a molecular weight of 210.30 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminocyclopentyl)-2-(1,3-thiazol-2-yl)ethanone is sourced from PubChem (CID 116587134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).