[2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol

C14H23N3O — CID 117156204

IUPAC[2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol
SMILESCN1CCCC1Cc1cn2c(n1)CC(CO)CC2
InChIInChI=1S/C14H23N3O/c1-16-5-2-3-13(16)8-12-9-17-6-4-11(10-18)7-14(17)15-12/h9,11,13,18H,2-8,10H2,1H3
InChIKeyOZISKTWCMIXTDG-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.07
Rot. Bonds3

About [2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol

[2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol (PubChem CID 117156204) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is [2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol.

Molecular Properties

Compound Name[2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol
PubChem CID117156204
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name[2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol
SMILESCN1CCCC1Cc1cn2c(n1)CC(CO)CC2
InChIInChI=1S/C14H23N3O/c1-16-5-2-3-13(16)8-12-9-17-6-4-11(10-18)7-14(17)15-12/h9,11,13,18H,2-8,10H2,1H3
InChIKeyOZISKTWCMIXTDG-UHFFFAOYSA-N
XLogP1.07
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol?
The IUPAC name of [2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol (CID 117156204) is [2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol.
What is the SMILES notation for [2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol?
The canonical SMILES for [2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol is CN1CCCC1Cc1cn2c(n1)CC(CO)CC2.
What is the InChIKey of [2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol?
The InChIKey is OZISKTWCMIXTDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-16-5-2-3-13(16)8-12-9-17-6-4-11(10-18)7-14(17)15-12/h9,11,13,18H,2-8,10H2,1H3.
What are the key properties of [2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol?
[2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol has a molecular weight of 249.36 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(1-methylpyrrolidin-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methanol is sourced from PubChem (CID 117156204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).