[1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol

C9H17NO — CID 4207620

IUPAC[1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1CC1CC1
InChIInChI=1S/C9H17NO/c11-7-9-2-1-5-10(9)6-8-3-4-8/h8-9,11H,1-7H2
InChIKeyVVPQQGSILHUAQR-UHFFFAOYSA-N
MW155.24 g/mol
LogP0.85
Rot. Bonds3

About [1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol

[1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol (PubChem CID 4207620) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is [1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol
PubChem CID4207620
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name[1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1CC1CC1
InChIInChI=1S/C9H17NO/c11-7-9-2-1-5-10(9)6-8-3-4-8/h8-9,11H,1-7H2
InChIKeyVVPQQGSILHUAQR-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-(cyclopropylmethyl)pyrrolidin-2-yl]methanol?
The IUPAC name of [1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol (CID 4207620) is [1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol is OCC1CCCN1CC1CC1.
What is the InChIKey of [1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol?
The InChIKey is VVPQQGSILHUAQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c11-7-9-2-1-5-10(9)6-8-3-4-8/h8-9,11H,1-7H2.
What are the key properties of [1-(cyclopropylmethyl)pyrrolidin-2-yl]methanol?
[1-(cyclopropylmethyl)pyrrolidin-2-yl]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-(cyclopropylmethyl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 4207620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).