1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol

C14H23NO2 — CID 65107011

IUPAC1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol
SMILESCCC(NCC1(O)CCCCC1)c1ccco1
InChIInChI=1S/C14H23NO2/c1-2-12(13-7-6-10-17-13)15-11-14(16)8-4-3-5-9-14/h6-7,10,12,15-16H,2-5,8-9,11H2,1H3
InChIKeyCJPQHJACXAEWRJ-UHFFFAOYSA-N
MW237.34 g/mol
LogP3.02
Rot. Bonds5

About 1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol

1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol (PubChem CID 65107011) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol
PubChem CID65107011
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol
SMILESCCC(NCC1(O)CCCCC1)c1ccco1
InChIInChI=1S/C14H23NO2/c1-2-12(13-7-6-10-17-13)15-11-14(16)8-4-3-5-9-14/h6-7,10,12,15-16H,2-5,8-9,11H2,1H3
InChIKeyCJPQHJACXAEWRJ-UHFFFAOYSA-N
XLogP3.02
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[1-(furan-2-yl)propylamino]methyl]-4,4-dimethylcyclohexan-1-ol
CID 65115344
N-[(1,4-dimethylpiperidin-4-yl)methyl]-1-(furan-2-yl)propan-1-amine
CID 107163253
1-[[1-(3-fluorophenyl)propylamino]methyl]cyclohexan-1-ol
CID 114871638
N-(cyclohexylmethyl)-1-(furan-2-yl)propan-1-amine
CID 62633963
1-[[1-(3,4-dichlorophenyl)propylamino]methyl]cyclohexan-1-ol
CID 65106925
1-(furan-2-yl)-N-[(3-methoxyoxolan-3-yl)methyl]propan-1-amine
CID 104759685
4-[[1-(furan-2-yl)ethylamino]methyl]thian-4-ol
CID 115722103
2-[1-(furan-2-yl)propylamino]-N-propan-2-ylacetamide
CID 62633589
1-[[1-(2-methoxyphenyl)propylamino]methyl]cyclobutan-1-ol
CID 115692774
3-[1-(furan-2-yl)propylamino]-N-propan-2-ylpropanamide
CID 113409686
N'-[1-(furan-2-yl)propyl]ethane-1,2-diamine
CID 62633441
N-(2-cyclopentylethyl)-1-(furan-2-yl)propan-1-amine
CID 62633625

Frequently Asked Questions

What is the IUPAC name of 1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol?
The IUPAC name of 1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol (CID 65107011) is 1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol is CCC(NCC1(O)CCCCC1)c1ccco1.
What is the InChIKey of 1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol?
The InChIKey is CJPQHJACXAEWRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-2-12(13-7-6-10-17-13)15-11-14(16)8-4-3-5-9-14/h6-7,10,12,15-16H,2-5,8-9,11H2,1H3.
What are the key properties of 1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol?
1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol has a molecular weight of 237.34 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[1-(furan-2-yl)propylamino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 65107011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).