[1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol

C9H12ClNOS — CID 115763041

IUPAC[1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol
SMILESOCC1(NCc2ccc(Cl)s2)CC1
InChIInChI=1S/C9H12ClNOS/c10-8-2-1-7(13-8)5-11-9(6-12)3-4-9/h1-2,11-12H,3-6H2
InChIKeyGBUDQMWWKOTGFB-UHFFFAOYSA-N
MW217.72 g/mol
LogP2.02
Rot. Bonds4

About [1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol

[1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol (PubChem CID 115763041) has the molecular formula C9H12ClNOS and a molecular weight of 217.72 g/mol. Its IUPAC name is [1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol
PubChem CID115763041
Molecular FormulaC9H12ClNOS
Molecular Weight217.72 g/mol
Exact Mass217.03
IUPAC Name[1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol
SMILESOCC1(NCc2ccc(Cl)s2)CC1
InChIInChI=1S/C9H12ClNOS/c10-8-2-1-7(13-8)5-11-9(6-12)3-4-9/h1-2,11-12H,3-6H2
InChIKeyGBUDQMWWKOTGFB-UHFFFAOYSA-N
XLogP2.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.72
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(5-chlorothiophen-2-yl)methyl]-1-methylcyclobutan-1-amine
CID 115765786
[1-[(5-chloro-1,3-thiazol-2-yl)methylamino]cyclopropyl]methanol
CID 104879507
5-[[[1-(hydroxymethyl)cyclohexyl]amino]methyl]thiophene-2-carbonitrile
CID 115909562
[1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol
CID 66025210
2-[1-[[(5-chlorothiophen-2-yl)methylamino]methyl]cyclopropyl]ethanol
CID 114750264
2-[(5-chlorothiophen-2-yl)methylamino]ethanol
CID 28878613
1-[[(5-chlorothiophen-2-yl)methylamino]methyl]cyclobutane-1-carboxylic acid
CID 115246509
[1-(thiophen-2-ylmethylamino)cyclooctyl]methanol
CID 61056403
2-[1-[(5-chlorothiophen-2-yl)methylcarbamoylamino]cyclohexyl]acetic acid
CID 64701883
[1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol
CID 102837729
[1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol
CID 62520254
1-(5-chlorothiophen-2-yl)-N-[(1-methylcyclopropyl)methyl]methanamine
CID 103724290

Frequently Asked Questions

What is the IUPAC name of [1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol?
The IUPAC name of [1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol (CID 115763041) is [1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol.
What is the SMILES notation for [1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol?
The canonical SMILES for [1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol is OCC1(NCc2ccc(Cl)s2)CC1.
What is the InChIKey of [1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol?
The InChIKey is GBUDQMWWKOTGFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClNOS/c10-8-2-1-7(13-8)5-11-9(6-12)3-4-9/h1-2,11-12H,3-6H2.
What are the key properties of [1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol?
[1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol has a molecular weight of 217.72 g/mol, XLogP of 2.02, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol is sourced from PubChem (CID 115763041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).