3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol

C10H17NO2 — CID 175069867

IUPAC3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol
SMILESCC(CN(C)C)C(O)c1ccco1
InChIInChI=1S/C10H17NO2/c1-8(7-11(2)3)10(12)9-5-4-6-13-9/h4-6,8,10,12H,7H2,1-3H3
InChIKeyLEGAFWYFEGNUML-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.51
Rot. Bonds4

About 3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol

3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol (PubChem CID 175069867) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol
PubChem CID175069867
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol
SMILESCC(CN(C)C)C(O)c1ccco1
InChIInChI=1S/C10H17NO2/c1-8(7-11(2)3)10(12)9-5-4-6-13-9/h4-6,8,10,12H,7H2,1-3H3
InChIKeyLEGAFWYFEGNUML-UHFFFAOYSA-N
XLogP1.51
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R,2R)-1-(furan-2-yl)-2-methylpropane-1,3-diol
CID 11957999
1-(furan-2-yl)-2-methyloctan-1-ol
CID 44721006
1-(furan-2-yl)-2-methylbutane-1,3-diol
CID 72990739
1,3-bis(furan-2-yl)propane-1,2,3-triol
CID 70525722
(1S,2R)-1-(furan-2-yl)-2-nitropropan-1-ol
CID 44604534
1-(furan-2-yl)-2-[2-hydroxyethyl(methyl)amino]ethanol
CID 82216576
1-(furan-2-yl)-3-methyl-2-phenylpentan-1-ol
CID 115797403
4-(furan-2-yl)-4-hydroxy-3-methylbutan-2-one
CID 14223499
2-N-[furan-2-yl(phenyl)methyl]-1-N,1-N,3-trimethylbutane-1,2-diamine
CID 61477090
3-[[2-(furan-2-yl)-2-hydroxyethyl]-methylamino]propanoic acid
CID 82216587
(1S,3S)-1-(furan-2-yl)butane-1,3-diol
CID 46177371
1-(furan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 16795656

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol?
The IUPAC name of 3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol (CID 175069867) is 3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol.
What is the SMILES notation for 3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol?
The canonical SMILES for 3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol is CC(CN(C)C)C(O)c1ccco1.
What is the InChIKey of 3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol?
The InChIKey is LEGAFWYFEGNUML-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-8(7-11(2)3)10(12)9-5-4-6-13-9/h4-6,8,10,12H,7H2,1-3H3.
What are the key properties of 3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol?
3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol has a molecular weight of 183.25 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-1-(furan-2-yl)-2-methylpropan-1-ol is sourced from PubChem (CID 175069867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).