[3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol

C10H15NOS — CID 66059230

IUPAC[3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol
SMILESOCC1(Cc2ccsc2)CCNC1
InChIInChI=1S/C10H15NOS/c12-8-10(2-3-11-7-10)5-9-1-4-13-6-9/h1,4,6,11-12H,2-3,5,7-8H2
InChIKeyCWVLTHWIUDXBBX-UHFFFAOYSA-N
MW197.30 g/mol
LogP1.26
Rot. Bonds3

About [3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol

[3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol (PubChem CID 66059230) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is [3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol
PubChem CID66059230
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name[3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol
SMILESOCC1(Cc2ccsc2)CCNC1
InChIInChI=1S/C10H15NOS/c12-8-10(2-3-11-7-10)5-9-1-4-13-6-9/h1,4,6,11-12H,2-3,5,7-8H2
InChIKeyCWVLTHWIUDXBBX-UHFFFAOYSA-N
XLogP1.26
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(thiophen-3-ylmethyl)cyclopentyl]methanol
CID 66025022
[3-[(3,5-dimethylphenyl)methyl]pyrrolidin-3-yl]methanol
CID 66058599
[3-[(2,6-difluorophenyl)methyl]pyrrolidin-3-yl]methanol
CID 114934841
[3-[(2-chlorophenyl)methyl]pyrrolidin-3-yl]methanol
CID 66059643
N-[(3-ethylpyrrolidin-3-yl)methyl]-N-(thiophen-3-ylmethyl)cyclopropanamine
CID 63142695
1-(3-ethylpyrrolidin-3-yl)-2-thiophen-3-ylethanone
CID 116570374
1-(thiophen-3-ylmethyl)cyclopropane-1-carboxylic acid
CID 66025291
1-(3-methylpyrrolidin-3-yl)-3-thiophen-3-ylpropan-1-one
CID 116570036
3-ethyl-4-(thiophen-3-ylmethyl)piperidin-4-ol
CID 114510452
N-[(3-propylpyrrolidin-3-yl)methyl]-N-(thiophen-3-ylmethyl)cyclopropanamine
CID 63142747
[3-[(2,5-dichlorophenyl)methyl]pyrrolidin-3-yl]methanol
CID 66057552
(2R)-2-(thiophen-3-ylmethyl)pyrrolidine-2-carboxylic acid
CID 2761943

Frequently Asked Questions

What is the IUPAC name of [3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol?
The IUPAC name of [3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol (CID 66059230) is [3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol?
The canonical SMILES for [3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol is OCC1(Cc2ccsc2)CCNC1.
What is the InChIKey of [3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol?
The InChIKey is CWVLTHWIUDXBBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOS/c12-8-10(2-3-11-7-10)5-9-1-4-13-6-9/h1,4,6,11-12H,2-3,5,7-8H2.
What are the key properties of [3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol?
[3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol has a molecular weight of 197.30 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 66059230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).