3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol

C10H15NOS — CID 117240284

IUPAC3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol
SMILESOCC(CNC1CC1)c1cccs1
InChIInChI=1S/C10H15NOS/c12-7-8(6-11-9-3-4-9)10-2-1-5-13-10/h1-2,5,8-9,11-12H,3-4,6-7H2
InChIKeyJTKNGTXWZPJZKD-UHFFFAOYSA-N
MW197.30 g/mol
LogP1.58
Rot. Bonds5

About 3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol

3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol (PubChem CID 117240284) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is 3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol.

Molecular Properties

Compound Name3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol
PubChem CID117240284
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol
SMILESOCC(CNC1CC1)c1cccs1
InChIInChI=1S/C10H15NOS/c12-7-8(6-11-9-3-4-9)10-2-1-5-13-10/h1-2,5,8-9,11-12H,3-4,6-7H2
InChIKeyJTKNGTXWZPJZKD-UHFFFAOYSA-N
XLogP1.58
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(methylamino)-2-thiophen-2-ylpropan-1-ol
CID 117240343
2-(5-chlorothiophen-2-yl)-3-(cyclopropylamino)propan-1-ol
CID 117240288
3-sulfanyl-2-thiophen-2-ylpropan-1-ol
CID 117240751
3-(cyclopropylamino)-2-(4-fluorophenyl)propan-1-ol
CID 117244719
3-(cyclopropylamino)-2-pyridin-2-ylpropan-1-ol
CID 117241410
2-cyclopropyl-2-thiophen-2-ylethanol
CID 64989110
N'-(4-ethylcyclohexyl)-N,N-dimethyl-1-thiophen-2-ylethane-1,2-diamine
CID 43079511
2-(3-bromophenyl)-3-(cyclopropylamino)propan-1-ol
CID 117242819
N-[2-(4-methylphenyl)-3-thiophen-2-ylpropyl]cyclopropanamine
CID 79437348
1-propan-2-yl-N-(2-thiophen-2-ylpropyl)piperidin-4-amine
CID 75428213
N,N-dimethyl-N'-piperidin-4-yl-1-thiophen-2-ylethane-1,2-diamine
CID 54902452
(6S)-6-(2-thiophen-2-ylpentylamino)-5,6,7,8-tetrahydronaphthalen-1-ol;hydrochloride
CID 67425102

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol?
The IUPAC name of 3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol (CID 117240284) is 3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol.
What is the SMILES notation for 3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol?
The canonical SMILES for 3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol is OCC(CNC1CC1)c1cccs1.
What is the InChIKey of 3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol?
The InChIKey is JTKNGTXWZPJZKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOS/c12-7-8(6-11-9-3-4-9)10-2-1-5-13-10/h1-2,5,8-9,11-12H,3-4,6-7H2.
What are the key properties of 3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol?
3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol has a molecular weight of 197.30 g/mol, XLogP of 1.58, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-2-thiophen-2-ylpropan-1-ol is sourced from PubChem (CID 117240284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).