1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol

C15H24N2O2 — CID 115771061

IUPAC1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol
SMILESCOc1cc(C)nc(CN2CCCC2CC(C)O)c1
InChIInChI=1S/C15H24N2O2/c1-11-7-15(19-3)9-13(16-11)10-17-6-4-5-14(17)8-12(2)18/h7,9,12,14,18H,4-6,8,10H2,1-3H3
InChIKeyBMNOGAOIWPIXAD-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.13
Rot. Bonds5

About 1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol

1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol (PubChem CID 115771061) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol.

Molecular Properties

Compound Name1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol
PubChem CID115771061
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol
SMILESCOc1cc(C)nc(CN2CCCC2CC(C)O)c1
InChIInChI=1S/C15H24N2O2/c1-11-7-15(19-3)9-13(16-11)10-17-6-4-5-14(17)8-12(2)18/h7,9,12,14,18H,4-6,8,10H2,1-3H3
InChIKeyBMNOGAOIWPIXAD-UHFFFAOYSA-N
XLogP2.13
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol?
The IUPAC name of 1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol (CID 115771061) is 1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol.
What is the SMILES notation for 1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol?
The canonical SMILES for 1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol is COc1cc(C)nc(CN2CCCC2CC(C)O)c1.
What is the InChIKey of 1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol?
The InChIKey is BMNOGAOIWPIXAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11-7-15(19-3)9-13(16-11)10-17-6-4-5-14(17)8-12(2)18/h7,9,12,14,18H,4-6,8,10H2,1-3H3.
What are the key properties of 1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol?
1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol has a molecular weight of 264.37 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol is sourced from PubChem (CID 115771061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).