[1-(hydroxymethyl)cyclopropyl]methanol

C5H10O2 — CID 4101437

IUPAC[1-(hydroxymethyl)cyclopropyl]methanol
SMILESOCC1(CO)CC1
InChIInChI=1S/C5H10O2/c6-3-5(4-7)1-2-5/h6-7H,1-4H2
InChIKeyYAINYZJQSQEGND-UHFFFAOYSA-N
MW102.13 g/mol
LogP-0.25
Rot. Bonds2

About [1-(hydroxymethyl)cyclopropyl]methanol

[1-(hydroxymethyl)cyclopropyl]methanol (PubChem CID 4101437) has the molecular formula C5H10O2 and a molecular weight of 102.13 g/mol. Its IUPAC name is [1-(hydroxymethyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[1-(hydroxymethyl)cyclopropyl]methanol
PubChem CID4101437
Molecular FormulaC5H10O2
Molecular Weight102.13 g/mol
Exact Mass102.07
IUPAC Name[1-(hydroxymethyl)cyclopropyl]methanol
SMILESOCC1(CO)CC1
InChIInChI=1S/C5H10O2/c6-3-5(4-7)1-2-5/h6-7H,1-4H2
InChIKeyYAINYZJQSQEGND-UHFFFAOYSA-N
XLogP-0.25
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.13
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(hydroxymethyl)cyclopropyl]methanol?
The IUPAC name of [1-(hydroxymethyl)cyclopropyl]methanol (CID 4101437) is [1-(hydroxymethyl)cyclopropyl]methanol.
What is the SMILES notation for [1-(hydroxymethyl)cyclopropyl]methanol?
The canonical SMILES for [1-(hydroxymethyl)cyclopropyl]methanol is OCC1(CO)CC1.
What is the InChIKey of [1-(hydroxymethyl)cyclopropyl]methanol?
The InChIKey is YAINYZJQSQEGND-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O2/c6-3-5(4-7)1-2-5/h6-7H,1-4H2.
What are the key properties of [1-(hydroxymethyl)cyclopropyl]methanol?
[1-(hydroxymethyl)cyclopropyl]methanol has a molecular weight of 102.13 g/mol, XLogP of -0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(hydroxymethyl)cyclopropyl]methanol is sourced from PubChem (CID 4101437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).