2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol

C16H27N3O — CID 117157769

IUPAC2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
SMILESCC(C)N1CCC(Cc2cn3c(n2)C(O)CCC3)CC1
InChIInChI=1S/C16H27N3O/c1-12(2)18-8-5-13(6-9-18)10-14-11-19-7-3-4-15(20)16(19)17-14/h11-13,15,20H,3-10H2,1-2H3
InChIKeyPGHHQZZEXWMDKD-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.37
Rot. Bonds3

About 2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol

2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol (PubChem CID 117157769) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is 2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol.

Molecular Properties

Compound Name2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
PubChem CID117157769
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
SMILESCC(C)N1CCC(Cc2cn3c(n2)C(O)CCC3)CC1
InChIInChI=1S/C16H27N3O/c1-12(2)18-8-5-13(6-9-18)10-14-11-19-7-3-4-15(20)16(19)17-14/h11-13,15,20H,3-10H2,1-2H3
InChIKeyPGHHQZZEXWMDKD-UHFFFAOYSA-N
XLogP2.37
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
The IUPAC name of 2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol (CID 117157769) is 2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol.
What is the SMILES notation for 2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
The canonical SMILES for 2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol is CC(C)N1CCC(Cc2cn3c(n2)C(O)CCC3)CC1.
What is the InChIKey of 2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
The InChIKey is PGHHQZZEXWMDKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-12(2)18-8-5-13(6-9-18)10-14-11-19-7-3-4-15(20)16(19)17-14/h11-13,15,20H,3-10H2,1-2H3.
What are the key properties of 2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol has a molecular weight of 277.41 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol is sourced from PubChem (CID 117157769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).