[2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol

C14H21N3O2 — CID 63171090

IUPAC[2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol
SMILESOCc1ccnc(N2CCC(N3CCOCC3)C2)c1
InChIInChI=1S/C14H21N3O2/c18-11-12-1-3-15-14(9-12)17-4-2-13(10-17)16-5-7-19-8-6-16/h1,3,9,13,18H,2,4-8,10-11H2
InChIKeyDRFWWVAEDGFJRQ-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.48
Rot. Bonds3

About [2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol

[2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol (PubChem CID 63171090) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is [2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol
PubChem CID63171090
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name[2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol
SMILESOCc1ccnc(N2CCC(N3CCOCC3)C2)c1
InChIInChI=1S/C14H21N3O2/c18-11-12-1-3-15-14(9-12)17-4-2-13(10-17)16-5-7-19-8-6-16/h1,3,9,13,18H,2,4-8,10-11H2
InChIKeyDRFWWVAEDGFJRQ-UHFFFAOYSA-N
XLogP0.48
TPSA48.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol?
The IUPAC name of [2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol (CID 63171090) is [2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol.
What is the SMILES notation for [2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol?
The canonical SMILES for [2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol is OCc1ccnc(N2CCC(N3CCOCC3)C2)c1.
What is the InChIKey of [2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol?
The InChIKey is DRFWWVAEDGFJRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c18-11-12-1-3-15-14(9-12)17-4-2-13(10-17)16-5-7-19-8-6-16/h1,3,9,13,18H,2,4-8,10-11H2.
What are the key properties of [2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol?
[2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol has a molecular weight of 263.34 g/mol, XLogP of 0.48, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol is sourced from PubChem (CID 63171090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).