[1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol

C10H14BrNOS — CID 102837729

IUPAC[1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol
SMILESCc1sc(CNC2(CO)CC2)cc1Br
InChIInChI=1S/C10H14BrNOS/c1-7-9(11)4-8(14-7)5-12-10(6-13)2-3-10/h4,12-13H,2-3,5-6H2,1H3
InChIKeyRJRIUBRFCRPSSB-UHFFFAOYSA-N
MW276.20 g/mol
LogP2.43
Rot. Bonds4

About [1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol

[1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol (PubChem CID 102837729) has the molecular formula C10H14BrNOS and a molecular weight of 276.20 g/mol. Its IUPAC name is [1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol
PubChem CID102837729
Molecular FormulaC10H14BrNOS
Molecular Weight276.20 g/mol
Exact Mass275.00
IUPAC Name[1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol
SMILESCc1sc(CNC2(CO)CC2)cc1Br
InChIInChI=1S/C10H14BrNOS/c1-7-9(11)4-8(14-7)5-12-10(6-13)2-3-10/h4,12-13H,2-3,5-6H2,1H3
InChIKeyRJRIUBRFCRPSSB-UHFFFAOYSA-N
XLogP2.43
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.20
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol with MolForge

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Related Compounds

[1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopentyl]methanol
CID 102835457
[4-[(4-bromo-5-methylthiophen-2-yl)methylamino]oxan-4-yl]methanol
CID 106297047
N-[(4-bromo-5-methylthiophen-2-yl)methyl]adamantan-1-amine
CID 102830012
[1-[(2,5-dimethylthiophen-3-yl)methylamino]cyclopropyl]methanol
CID 115763026
2-[(4-bromo-5-methylthiophen-2-yl)methylamino]propan-1-ol
CID 102831611
2-[2-[(4-bromo-5-methylthiophen-2-yl)methylamino]ethoxy]ethanol
CID 102831297
[1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol
CID 115763041
1-[[(4-bromo-5-methylthiophen-2-yl)methylamino]methyl]-N,N-dimethylcyclopentan-1-amine
CID 102837189
[1-[(2-methyl-1,3-thiazol-5-yl)methylamino]cyclopentyl]methanol
CID 62522547
N-[(4-bromo-5-chlorothiophen-2-yl)methyl]-1-ethylcyclobutan-1-amine
CID 102837609
[1-[(2,5-dimethylthiophen-3-yl)methylamino]cyclohexyl]methanol
CID 62521865
[1-[(2-ethyl-1,3-thiazol-5-yl)methylamino]cyclopropyl]methanol
CID 115763147

Frequently Asked Questions

What is the IUPAC name of [1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol?
The IUPAC name of [1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol (CID 102837729) is [1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol.
What is the SMILES notation for [1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol?
The canonical SMILES for [1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol is Cc1sc(CNC2(CO)CC2)cc1Br.
What is the InChIKey of [1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol?
The InChIKey is RJRIUBRFCRPSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrNOS/c1-7-9(11)4-8(14-7)5-12-10(6-13)2-3-10/h4,12-13H,2-3,5-6H2,1H3.
What are the key properties of [1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol?
[1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol has a molecular weight of 276.20 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(4-bromo-5-methylthiophen-2-yl)methylamino]cyclopropyl]methanol is sourced from PubChem (CID 102837729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).