[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol

C9H17NO — CID 66854227

IUPAC[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol
SMILESOCC1(CN2CCCC2)CC1
InChIInChI=1S/C9H17NO/c11-8-9(3-4-9)7-10-5-1-2-6-10/h11H,1-8H2
InChIKeyWBINCNSXRSXVFP-UHFFFAOYSA-N
MW155.24 g/mol
LogP0.85
Rot. Bonds3

About [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol

[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol (PubChem CID 66854227) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol
PubChem CID66854227
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol
SMILESOCC1(CN2CCCC2)CC1
InChIInChI=1S/C9H17NO/c11-8-9(3-4-9)7-10-5-1-2-6-10/h11H,1-8H2
InChIKeyWBINCNSXRSXVFP-UHFFFAOYSA-N
XLogP0.85
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol?
The IUPAC name of [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol (CID 66854227) is [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol.
What is the SMILES notation for [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol?
The canonical SMILES for [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol is OCC1(CN2CCCC2)CC1.
What is the InChIKey of [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol?
The InChIKey is WBINCNSXRSXVFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c11-8-9(3-4-9)7-10-5-1-2-6-10/h11H,1-8H2.
What are the key properties of [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol?
[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol has a molecular weight of 155.24 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanol is sourced from PubChem (CID 66854227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).