2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol

C16H27NO2 — CID 62608837

IUPAC2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)C(CN(C)Cc2ccco2)C1
InChIInChI=1S/C16H27NO2/c1-3-5-13-7-8-16(18)14(10-13)11-17(2)12-15-6-4-9-19-15/h4,6,9,13-14,16,18H,3,5,7-8,10-12H2,1-2H3
InChIKeyUHJZDZCWXNIIEG-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.29
Rot. Bonds6

About 2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol

2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol (PubChem CID 62608837) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol.

Molecular Properties

Compound Name2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol
PubChem CID62608837
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)C(CN(C)Cc2ccco2)C1
InChIInChI=1S/C16H27NO2/c1-3-5-13-7-8-16(18)14(10-13)11-17(2)12-15-6-4-9-19-15/h4,6,9,13-14,16,18H,3,5,7-8,10-12H2,1-2H3
InChIKeyUHJZDZCWXNIIEG-UHFFFAOYSA-N
XLogP3.29
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine
CID 62611413
2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine
CID 62616432
1-(furan-2-yl)-N-(furan-2-ylmethyl)-N-methylmethanamine;hydrochloride
CID 3028206
N-(furan-2-ylmethyl)-N-methyl-1-piperidin-4-ylmethanamine
CID 16768453
2-[(4-fluoro-N-methylanilino)methyl]-4-propylcyclohexan-1-ol
CID 63488559
2-[[furan-2-ylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-ol
CID 64734697
2-[[furan-2-ylmethyl(methyl)amino]methyl]-N-propylcyclopentan-1-amine
CID 62616260
1-(4-ethylpiperidin-2-yl)-N-(furan-2-ylmethyl)-N-methylmethanamine
CID 114430753
2-[(3-fluoro-N-methylanilino)methyl]-4-propylcyclohexan-1-ol
CID 63489444
N-ethyl-2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62708305
2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-one
CID 62612741
4-ethyl-2-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclohexan-1-ol
CID 62609412

Frequently Asked Questions

What is the IUPAC name of 2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol?
The IUPAC name of 2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol (CID 62608837) is 2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol.
What is the SMILES notation for 2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol?
The canonical SMILES for 2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol is CCCC1CCC(O)C(CN(C)Cc2ccco2)C1.
What is the InChIKey of 2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol?
The InChIKey is UHJZDZCWXNIIEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-3-5-13-7-8-16(18)14(10-13)11-17(2)12-15-6-4-9-19-15/h4,6,9,13-14,16,18H,3,5,7-8,10-12H2,1-2H3.
What are the key properties of 2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol?
2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol has a molecular weight of 265.40 g/mol, XLogP of 3.29, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol is sourced from PubChem (CID 62608837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).