[1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol

C15H25NOS — CID 81419823

IUPAC[1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol
SMILESCCC(NCC1(CO)CCCCC1)c1cccs1
InChIInChI=1S/C15H25NOS/c1-2-13(14-7-6-10-18-14)16-11-15(12-17)8-4-3-5-9-15/h6-7,10,13,16-17H,2-5,8-9,11-12H2,1H3
InChIKeyJFMUWKCKIQGCCW-UHFFFAOYSA-N
MW267.44 g/mol
LogP3.73
Rot. Bonds6

About [1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol

[1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol (PubChem CID 81419823) has the molecular formula C15H25NOS and a molecular weight of 267.44 g/mol. Its IUPAC name is [1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol
PubChem CID81419823
Molecular FormulaC15H25NOS
Molecular Weight267.44 g/mol
Exact Mass267.17
IUPAC Name[1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol
SMILESCCC(NCC1(CO)CCCCC1)c1cccs1
InChIInChI=1S/C15H25NOS/c1-2-13(14-7-6-10-18-14)16-11-15(12-17)8-4-3-5-9-15/h6-7,10,13,16-17H,2-5,8-9,11-12H2,1H3
InChIKeyJFMUWKCKIQGCCW-UHFFFAOYSA-N
XLogP3.73
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[(1-thiophen-2-ylpropylamino)methyl]cyclopentyl]methanol
CID 115358763
[1-[[(2-methyl-1-thiophen-2-ylpropyl)amino]methyl]cyclohexyl]methanol
CID 81413063
[1-[[(2-methyl-1-thiophen-2-ylpropyl)amino]methyl]cyclopentyl]methanol
CID 113293621
2-[1-[(1-thiophen-2-ylpropylamino)methyl]cyclopropyl]acetonitrile
CID 65495404
[1-[[1-(2-methoxyphenyl)propylamino]methyl]cyclopentyl]methanol
CID 115358414
[1-[[1-(3-bromophenyl)propylamino]methyl]cyclopentyl]methanol
CID 115358941
1-(1-thiophen-2-ylpropylcarbamoyl)cyclopropane-1-carboxylic acid
CID 62096618
N-(1-oxaspiro[4.5]decan-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine
CID 102897054
N-(1,3-dioxolan-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine
CID 75504547
methyl 3-(1-thiophen-2-ylpropylamino)propanoate
CID 43139675
N-[(2,2-dimethylcyclopropyl)methyl]-1-thiophen-2-ylpropan-1-amine
CID 103902072
N-(1-thiophen-2-ylpropyl)spiro[4.5]decan-8-amine
CID 114817555

Frequently Asked Questions

What is the IUPAC name of [1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol?
The IUPAC name of [1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol (CID 81419823) is [1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol is CCC(NCC1(CO)CCCCC1)c1cccs1.
What is the InChIKey of [1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol?
The InChIKey is JFMUWKCKIQGCCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NOS/c1-2-13(14-7-6-10-18-14)16-11-15(12-17)8-4-3-5-9-15/h6-7,10,13,16-17H,2-5,8-9,11-12H2,1H3.
What are the key properties of [1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol?
[1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol has a molecular weight of 267.44 g/mol, XLogP of 3.73, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-thiophen-2-ylpropylamino)methyl]cyclohexyl]methanol is sourced from PubChem (CID 81419823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).