[1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol

C12H19NO2S — CID 115711097

IUPAC[1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol
SMILESCOc1ccsc1CNC1(CO)CCCC1
InChIInChI=1S/C12H19NO2S/c1-15-10-4-7-16-11(10)8-13-12(9-14)5-2-3-6-12/h4,7,13-14H,2-3,5-6,8-9H2,1H3
InChIKeyUSOZAMMSZAESOY-UHFFFAOYSA-N
MW241.36 g/mol
LogP2.15
Rot. Bonds5

About [1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol

[1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol (PubChem CID 115711097) has the molecular formula C12H19NO2S and a molecular weight of 241.36 g/mol. Its IUPAC name is [1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol
PubChem CID115711097
Molecular FormulaC12H19NO2S
Molecular Weight241.36 g/mol
Exact Mass241.11
IUPAC Name[1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol
SMILESCOc1ccsc1CNC1(CO)CCCC1
InChIInChI=1S/C12H19NO2S/c1-15-10-4-7-16-11(10)8-13-12(9-14)5-2-3-6-12/h4,7,13-14H,2-3,5-6,8-9H2,1H3
InChIKeyUSOZAMMSZAESOY-UHFFFAOYSA-N
XLogP2.15
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(hydroxymethyl)cyclohexyl]-3-methoxythiophene-2-carboxamide
CID 81122084
[1-[(3,4-dimethoxyphenyl)methylamino]cyclobutyl]methanol
CID 115733291
2-[(3-methoxythiophen-2-yl)methylamino]ethanol
CID 115710462
[1-[(2,3,4-trimethoxyphenyl)methylamino]cyclobutyl]methanol
CID 115733194
[1-(thiophen-2-ylmethylamino)cyclopentyl]methanol
CID 61054389
[1-(thiophen-2-ylmethylamino)cyclooctyl]methanol
CID 61056403
[1-[(3-ethoxy-4-methoxyphenyl)methylamino]cyclohexyl]methanol
CID 62519917
N-[(3-methoxythiophen-2-yl)methyl]-3-methylcyclobutan-1-amine
CID 115711072
[1-[(4-methoxy-3-nitrophenyl)methylamino]cyclobutyl]methanol
CID 115733413
N-[[1-(hydroxymethyl)cyclohexyl]methyl]-3-methoxythiophene-2-carboxamide
CID 112699709
[1-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]cyclohexyl]methanol
CID 62520799
N-[2-[[[4-(hydroxymethyl)oxan-4-yl]amino]methyl]thiophen-3-yl]acetamide
CID 106297078

Frequently Asked Questions

What is the IUPAC name of [1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol?
The IUPAC name of [1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol (CID 115711097) is [1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol.
What is the SMILES notation for [1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol?
The canonical SMILES for [1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol is COc1ccsc1CNC1(CO)CCCC1.
What is the InChIKey of [1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol?
The InChIKey is USOZAMMSZAESOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2S/c1-15-10-4-7-16-11(10)8-13-12(9-14)5-2-3-6-12/h4,7,13-14H,2-3,5-6,8-9H2,1H3.
What are the key properties of [1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol?
[1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol has a molecular weight of 241.36 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-methoxythiophen-2-yl)methylamino]cyclopentyl]methanol is sourced from PubChem (CID 115711097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).