2-(furan-2-ylmethyl)cycloheptan-1-ol

C12H18O2 — CID 62999043

IUPAC2-(furan-2-ylmethyl)cycloheptan-1-ol
SMILESOC1CCCCCC1Cc1ccco1
InChIInChI=1S/C12H18O2/c13-12-7-3-1-2-5-10(12)9-11-6-4-8-14-11/h4,6,8,10,12-13H,1-3,5,7,9H2
InChIKeyRJPOJFXFLQKVIA-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.76
Rot. Bonds2

About 2-(furan-2-ylmethyl)cycloheptan-1-ol

2-(furan-2-ylmethyl)cycloheptan-1-ol (PubChem CID 62999043) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 2-(furan-2-ylmethyl)cycloheptan-1-ol.

Molecular Properties

Compound Name2-(furan-2-ylmethyl)cycloheptan-1-ol
PubChem CID62999043
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name2-(furan-2-ylmethyl)cycloheptan-1-ol
SMILESOC1CCCCCC1Cc1ccco1
InChIInChI=1S/C12H18O2/c13-12-7-3-1-2-5-10(12)9-11-6-4-8-14-11/h4,6,8,10,12-13H,1-3,5,7,9H2
InChIKeyRJPOJFXFLQKVIA-UHFFFAOYSA-N
XLogP2.76
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclobutylmethyl)furan
CID 139469251
3-(furan-2-yl)-N-[(2-hydroxycyclohexyl)methyl]propanamide
CID 64928523
2-cyclohexyl-1-(furan-2-yl)propan-2-ol
CID 114794875
N-[(1S,2R)-2-(furan-2-ylmethyl)cyclohexyl]adamantane-1-carboxamide
CID 40573046
4-(furan-2-ylmethyl)piperidine
CID 83480581
N-[(1R,2R)-2-(furan-2-ylmethyl)cyclohexyl]-3-phenylpropanamide
CID 40505929
2-[ethyl(furan-2-ylmethyl)amino]cyclohexan-1-ol
CID 61423026
2-(furan-2-ylmethyl)oxan-3-amine
CID 82408405
4-cyclohexyl-1-(furan-2-yl)butan-2-ol
CID 115830128
1,5-bis(furan-2-ylmethyl)-8-(2-hydroxycyclononyl)-1,5-diazonan-7-ol
CID 70112543
2-(cyclopentyloxymethyl)furan
CID 57019215
2-[cyclohexyl(furan-2-ylmethyl)amino]ethanol
CID 62016796

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-ylmethyl)cycloheptan-1-ol?
The IUPAC name of 2-(furan-2-ylmethyl)cycloheptan-1-ol (CID 62999043) is 2-(furan-2-ylmethyl)cycloheptan-1-ol.
What is the SMILES notation for 2-(furan-2-ylmethyl)cycloheptan-1-ol?
The canonical SMILES for 2-(furan-2-ylmethyl)cycloheptan-1-ol is OC1CCCCCC1Cc1ccco1.
What is the InChIKey of 2-(furan-2-ylmethyl)cycloheptan-1-ol?
The InChIKey is RJPOJFXFLQKVIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c13-12-7-3-1-2-5-10(12)9-11-6-4-8-14-11/h4,6,8,10,12-13H,1-3,5,7,9H2.
What are the key properties of 2-(furan-2-ylmethyl)cycloheptan-1-ol?
2-(furan-2-ylmethyl)cycloheptan-1-ol has a molecular weight of 194.27 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-ylmethyl)cycloheptan-1-ol is sourced from PubChem (CID 62999043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).