3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol

C15H27NO2 — CID 83175769

IUPAC3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol
SMILESCCN(CC)C(CC)(CC)C(O)Cc1ccoc1
InChIInChI=1S/C15H27NO2/c1-5-15(6-2,16(7-3)8-4)14(17)11-13-9-10-18-12-13/h9-10,12,14,17H,5-8,11H2,1-4H3
InChIKeyURDMLKNVCKWVCL-UHFFFAOYSA-N
MW253.39 g/mol
LogP3.08
Rot. Bonds8

About 3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol

3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol (PubChem CID 83175769) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is 3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol.

Molecular Properties

Compound Name3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol
PubChem CID83175769
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol
SMILESCCN(CC)C(CC)(CC)C(O)Cc1ccoc1
InChIInChI=1S/C15H27NO2/c1-5-15(6-2,16(7-3)8-4)14(17)11-13-9-10-18-12-13/h9-10,12,14,17H,5-8,11H2,1-4H3
InChIKeyURDMLKNVCKWVCL-UHFFFAOYSA-N
XLogP3.08
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-N,3-N-diethyl-1-(furan-3-yl)-3-methylbutane-2,3-diamine
CID 83175467
1-(furan-3-yl)butan-2-ol
CID 83171486
1-(5-bromothiophen-2-yl)-3-(diethylamino)-3-ethylpentan-2-ol
CID 79061202
4-(furan-3-yl)-3-methylbutan-2-ol
CID 83182885
3-(diethylamino)-3-ethyl-1-(2-methyl-1,2,4-triazol-3-yl)pentan-2-ol
CID 79061531
2-(diethylamino)-1-(furan-3-yl)-2-methylbutan-1-ol
CID 79063322
1,2-bis(furan-3-yl)ethanol
CID 83172033
1-ethylsulfanyl-3-(furan-3-yl)propan-2-ol
CID 83174968
3-(diethylamino)-3-methyl-1-(4-methylphenyl)pentan-2-ol
CID 79062947
2-(furan-3-yl)-1-(4-methylphenyl)ethanol
CID 11206462
1-(furan-3-yl)-3-(4-methylphenyl)propan-2-ol
CID 83171853
2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol
CID 83173147

Frequently Asked Questions

What is the IUPAC name of 3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol?
The IUPAC name of 3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol (CID 83175769) is 3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol.
What is the SMILES notation for 3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol?
The canonical SMILES for 3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol is CCN(CC)C(CC)(CC)C(O)Cc1ccoc1.
What is the InChIKey of 3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol?
The InChIKey is URDMLKNVCKWVCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-5-15(6-2,16(7-3)8-4)14(17)11-13-9-10-18-12-13/h9-10,12,14,17H,5-8,11H2,1-4H3.
What are the key properties of 3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol?
3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol has a molecular weight of 253.39 g/mol, XLogP of 3.08, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylamino)-3-ethyl-1-(furan-3-yl)pentan-2-ol is sourced from PubChem (CID 83175769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).