[2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol

C19H31N3O3 — CID 91921823

IUPAC[2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol
SMILESCOCCN1CC(CO)C2(CCN(Cc3cccc(OC)n3)CC2)C1
InChIInChI=1S/C19H31N3O3/c1-24-11-10-22-12-16(14-23)19(15-22)6-8-21(9-7-19)13-17-4-3-5-18(20-17)25-2/h3-5,16,23H,6-15H2,1-2H3
InChIKeySMDHHMFIQSVGRT-UHFFFAOYSA-N
MW349.48 g/mol
LogP1.24
Rot. Bonds7

About [2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol

[2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol (PubChem CID 91921823) has the molecular formula C19H31N3O3 and a molecular weight of 349.48 g/mol. Its IUPAC name is [2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol.

Molecular Properties

Compound Name[2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol
PubChem CID91921823
Molecular FormulaC19H31N3O3
Molecular Weight349.48 g/mol
Exact Mass349.24
IUPAC Name[2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol
SMILESCOCCN1CC(CO)C2(CCN(Cc3cccc(OC)n3)CC2)C1
InChIInChI=1S/C19H31N3O3/c1-24-11-10-22-12-16(14-23)19(15-22)6-8-21(9-7-19)13-17-4-3-5-18(20-17)25-2/h3-5,16,23H,6-15H2,1-2H3
InChIKeySMDHHMFIQSVGRT-UHFFFAOYSA-N
XLogP1.24
TPSA58.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.48
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol 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-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol?
The IUPAC name of [2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol (CID 91921823) is [2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol.
What is the SMILES notation for [2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol?
The canonical SMILES for [2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol is COCCN1CC(CO)C2(CCN(Cc3cccc(OC)n3)CC2)C1.
What is the InChIKey of [2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol?
The InChIKey is SMDHHMFIQSVGRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3O3/c1-24-11-10-22-12-16(14-23)19(15-22)6-8-21(9-7-19)13-17-4-3-5-18(20-17)25-2/h3-5,16,23H,6-15H2,1-2H3.
What are the key properties of [2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol?
[2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol has a molecular weight of 349.48 g/mol, XLogP of 1.24, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxyethyl)-8-[(6-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-4-yl]methanol is sourced from PubChem (CID 91921823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).