(5-cyclopropyl-1H-inden-2-yl)methanol

C13H14O — CID 159653822

IUPAC(5-cyclopropyl-1H-inden-2-yl)methanol
SMILESOCC1=Cc2cc(C3CC3)ccc2C1
InChIInChI=1S/C13H14O/c14-8-9-5-11-3-4-12(10-1-2-10)7-13(11)6-9/h3-4,6-7,10,14H,1-2,5,8H2
InChIKeyJXFAIRPYBSUTLC-UHFFFAOYSA-N
MW186.25 g/mol
LogP2.50
Rot. Bonds2

About (5-cyclopropyl-1H-inden-2-yl)methanol

(5-cyclopropyl-1H-inden-2-yl)methanol (PubChem CID 159653822) has the molecular formula C13H14O and a molecular weight of 186.25 g/mol. Its IUPAC name is (5-cyclopropyl-1H-inden-2-yl)methanol.

Molecular Properties

Compound Name(5-cyclopropyl-1H-inden-2-yl)methanol
PubChem CID159653822
Molecular FormulaC13H14O
Molecular Weight186.25 g/mol
Exact Mass186.10
IUPAC Name(5-cyclopropyl-1H-inden-2-yl)methanol
SMILESOCC1=Cc2cc(C3CC3)ccc2C1
InChIInChI=1S/C13H14O/c14-8-9-5-11-3-4-12(10-1-2-10)7-13(11)6-9/h3-4,6-7,10,14H,1-2,5,8H2
InChIKeyJXFAIRPYBSUTLC-UHFFFAOYSA-N
XLogP2.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (5-cyclopropyl-1H-inden-2-yl)methanol?
The IUPAC name of (5-cyclopropyl-1H-inden-2-yl)methanol (CID 159653822) is (5-cyclopropyl-1H-inden-2-yl)methanol.
What is the SMILES notation for (5-cyclopropyl-1H-inden-2-yl)methanol?
The canonical SMILES for (5-cyclopropyl-1H-inden-2-yl)methanol is OCC1=Cc2cc(C3CC3)ccc2C1.
What is the InChIKey of (5-cyclopropyl-1H-inden-2-yl)methanol?
The InChIKey is JXFAIRPYBSUTLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O/c14-8-9-5-11-3-4-12(10-1-2-10)7-13(11)6-9/h3-4,6-7,10,14H,1-2,5,8H2.
What are the key properties of (5-cyclopropyl-1H-inden-2-yl)methanol?
(5-cyclopropyl-1H-inden-2-yl)methanol has a molecular weight of 186.25 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclopropyl-1H-inden-2-yl)methanol is sourced from PubChem (CID 159653822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).