3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol

C10H15NOS — CID 80561841

IUPAC3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol
SMILESCc1ccsc1C1(O)CCC(N)C1
InChIInChI=1S/C10H15NOS/c1-7-3-5-13-9(7)10(12)4-2-8(11)6-10/h3,5,8,12H,2,4,6,11H2,1H3
InChIKeySEPHWTSDBXLWKV-UHFFFAOYSA-N
MW197.30 g/mol
LogP1.76
Rot. Bonds1

About 3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol

3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol (PubChem CID 80561841) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is 3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol.

Molecular Properties

Compound Name3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol
PubChem CID80561841
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol
SMILESCc1ccsc1C1(O)CCC(N)C1
InChIInChI=1S/C10H15NOS/c1-7-3-5-13-9(7)10(12)4-2-8(11)6-10/h3,5,8,12H,2,4,6,11H2,1H3
InChIKeySEPHWTSDBXLWKV-UHFFFAOYSA-N
XLogP1.76
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol?
The IUPAC name of 3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol (CID 80561841) is 3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol.
What is the SMILES notation for 3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol?
The canonical SMILES for 3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol is Cc1ccsc1C1(O)CCC(N)C1.
What is the InChIKey of 3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol?
The InChIKey is SEPHWTSDBXLWKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOS/c1-7-3-5-13-9(7)10(12)4-2-8(11)6-10/h3,5,8,12H,2,4,6,11H2,1H3.
What are the key properties of 3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol?
3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol has a molecular weight of 197.30 g/mol, XLogP of 1.76, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(3-methylthiophen-2-yl)cyclopentan-1-ol is sourced from PubChem (CID 80561841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).