[1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol

C12H19NO2 — CID 64866259

IUPAC[1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol
SMILESCC(Cc1ccco1)N1CCC(CO)C1
InChIInChI=1S/C12H19NO2/c1-10(7-12-3-2-6-15-12)13-5-4-11(8-13)9-14/h2-3,6,10-11,14H,4-5,7-9H2,1H3
InChIKeyOELUKHLHGAGBHA-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.52
Rot. Bonds4

About [1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol

[1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol (PubChem CID 64866259) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is [1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol
PubChem CID64866259
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name[1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol
SMILESCC(Cc1ccco1)N1CCC(CO)C1
InChIInChI=1S/C12H19NO2/c1-10(7-12-3-2-6-15-12)13-5-4-11(8-13)9-14/h2-3,6,10-11,14H,4-5,7-9H2,1H3
InChIKeyOELUKHLHGAGBHA-UHFFFAOYSA-N
XLogP1.52
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[1-(furan-2-yl)propan-2-yl]piperidin-4-yl]-N-methylmethanamine
CID 63250602
[1-(1-thiophen-2-ylpropan-2-yl)pyrrolidin-3-yl]methanol
CID 64867112
1-[1-(furan-2-yl)propan-2-yl]-N,3-dimethylpiperidin-4-amine
CID 54975952
2-[1-(furan-2-yl)propan-2-yl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79939766
[1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol
CID 95934404
3-[1-[1-(furan-2-yl)propan-2-yl]piperidin-3-yl]butanoic acid
CID 81046243
[1-[2-amino-1-(furan-2-yl)ethyl]pyrrolidin-3-yl]methanol
CID 112624466
[(3S)-1-[(1R)-1-(furan-2-yl)ethyl]piperidin-3-yl]methanol
CID 129373082
[(3S)-1-[(2R)-4-phenylsulfanylbutan-2-yl]pyrrolidin-3-yl]methanol
CID 97237730
(1-propan-2-ylpyrrolidin-3-yl)methanol
CID 16641305
1-(furan-2-yl)-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine
CID 63085135
2-[(3R)-3-aminopyrrolidin-1-yl]-N-(furan-2-ylmethyl)propanamide
CID 115301891

Frequently Asked Questions

What is the IUPAC name of [1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol?
The IUPAC name of [1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol (CID 64866259) is [1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol is CC(Cc1ccco1)N1CCC(CO)C1.
What is the InChIKey of [1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol?
The InChIKey is OELUKHLHGAGBHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-10(7-12-3-2-6-15-12)13-5-4-11(8-13)9-14/h2-3,6,10-11,14H,4-5,7-9H2,1H3.
What are the key properties of [1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol?
[1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol has a molecular weight of 209.29 g/mol, XLogP of 1.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol is sourced from PubChem (CID 64866259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).