(2R)-1-cyclopropylpropan-2-ol

C6H12O — CID 75539611

IUPAC(2R)-1-cyclopropylpropan-2-ol
SMILESC[C@@H](O)CC1CC1
InChIInChI=1S/C6H12O/c1-5(7)4-6-2-3-6/h5-7H,2-4H2,1H3/t5-/m1/s1
InChIKeyKNQQUHYWTTUEQJ-RXMQYKEDSA-N
MW100.16 g/mol
LogP1.17
Rot. Bonds2

About (2R)-1-cyclopropylpropan-2-ol

(2R)-1-cyclopropylpropan-2-ol (PubChem CID 75539611) has the molecular formula C6H12O and a molecular weight of 100.16 g/mol. Its IUPAC name is (2R)-1-cyclopropylpropan-2-ol.

Molecular Properties

Compound Name(2R)-1-cyclopropylpropan-2-ol
PubChem CID75539611
Molecular FormulaC6H12O
Molecular Weight100.16 g/mol
Exact Mass100.09
IUPAC Name(2R)-1-cyclopropylpropan-2-ol
SMILESC[C@@H](O)CC1CC1
InChIInChI=1S/C6H12O/c1-5(7)4-6-2-3-6/h5-7H,2-4H2,1H3/t5-/m1/s1
InChIKeyKNQQUHYWTTUEQJ-RXMQYKEDSA-N
XLogP1.17
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.16
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-cyclopropylpropan-2-ol?
The IUPAC name of (2R)-1-cyclopropylpropan-2-ol (CID 75539611) is (2R)-1-cyclopropylpropan-2-ol.
What is the SMILES notation for (2R)-1-cyclopropylpropan-2-ol?
The canonical SMILES for (2R)-1-cyclopropylpropan-2-ol is C[C@@H](O)CC1CC1.
What is the InChIKey of (2R)-1-cyclopropylpropan-2-ol?
The InChIKey is KNQQUHYWTTUEQJ-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H12O/c1-5(7)4-6-2-3-6/h5-7H,2-4H2,1H3/t5-/m1/s1.
What are the key properties of (2R)-1-cyclopropylpropan-2-ol?
(2R)-1-cyclopropylpropan-2-ol has a molecular weight of 100.16 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-cyclopropylpropan-2-ol is sourced from PubChem (CID 75539611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).