2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol

C14H22N2O2 — CID 114799454

IUPAC2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol
SMILESCC(C)Oc1cccnc1N1CCC(CCO)C1
InChIInChI=1S/C14H22N2O2/c1-11(2)18-13-4-3-7-15-14(13)16-8-5-12(10-16)6-9-17/h3-4,7,11-12,17H,5-6,8-10H2,1-2H3
InChIKeyUZSXCHYLSQXXDO-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.08
Rot. Bonds5

About 2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol

2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol (PubChem CID 114799454) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol
PubChem CID114799454
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol
SMILESCC(C)Oc1cccnc1N1CCC(CCO)C1
InChIInChI=1S/C14H22N2O2/c1-11(2)18-13-4-3-7-15-14(13)16-8-5-12(10-16)6-9-17/h3-4,7,11-12,17H,5-6,8-10H2,1-2H3
InChIKeyUZSXCHYLSQXXDO-UHFFFAOYSA-N
XLogP2.08
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol?
The IUPAC name of 2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol (CID 114799454) is 2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol?
The canonical SMILES for 2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol is CC(C)Oc1cccnc1N1CCC(CCO)C1.
What is the InChIKey of 2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol?
The InChIKey is UZSXCHYLSQXXDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11(2)18-13-4-3-7-15-14(13)16-8-5-12(10-16)6-9-17/h3-4,7,11-12,17H,5-6,8-10H2,1-2H3.
What are the key properties of 2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol?
2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol has a molecular weight of 250.34 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol is sourced from PubChem (CID 114799454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).