2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol

C12H23NO — CID 62610045

IUPAC2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol
SMILESCCC1CCCN1CC1CCCC1O
InChIInChI=1S/C12H23NO/c1-2-11-6-4-8-13(11)9-10-5-3-7-12(10)14/h10-12,14H,2-9H2,1H3
InChIKeySFJUBKWOPCPRGS-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.02
Rot. Bonds3

About 2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol

2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol (PubChem CID 62610045) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol
PubChem CID62610045
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol
SMILESCCC1CCCN1CC1CCCC1O
InChIInChI=1S/C12H23NO/c1-2-11-6-4-8-13(11)9-10-5-3-7-12(10)14/h10-12,14H,2-9H2,1H3
InChIKeySFJUBKWOPCPRGS-UHFFFAOYSA-N
XLogP2.02
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol?
The IUPAC name of 2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol (CID 62610045) is 2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol is CCC1CCCN1CC1CCCC1O.
What is the InChIKey of 2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol?
The InChIKey is SFJUBKWOPCPRGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-2-11-6-4-8-13(11)9-10-5-3-7-12(10)14/h10-12,14H,2-9H2,1H3.
What are the key properties of 2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol?
2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol has a molecular weight of 197.32 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 62610045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).