6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol

C14H23N3O — CID 82981269

IUPAC6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CN2CCN(C)C(C)(C)C2)n1
InChIInChI=1S/C14H23N3O/c1-11-5-6-13(18)12(15-11)9-17-8-7-16(4)14(2,3)10-17/h5-6,18H,7-10H2,1-4H3
InChIKeyFGLDSITUHKKNFH-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.62
Rot. Bonds2

About 6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol

6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol (PubChem CID 82981269) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol
PubChem CID82981269
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CN2CCN(C)C(C)(C)C2)n1
InChIInChI=1S/C14H23N3O/c1-11-5-6-13(18)12(15-11)9-17-8-7-16(4)14(2,3)10-17/h5-6,18H,7-10H2,1-4H3
InChIKeyFGLDSITUHKKNFH-UHFFFAOYSA-N
XLogP1.62
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol?
The IUPAC name of 6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol (CID 82981269) is 6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol.
What is the SMILES notation for 6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol?
The canonical SMILES for 6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol is Cc1ccc(O)c(CN2CCN(C)C(C)(C)C2)n1.
What is the InChIKey of 6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol?
The InChIKey is FGLDSITUHKKNFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-11-5-6-13(18)12(15-11)9-17-8-7-16(4)14(2,3)10-17/h5-6,18H,7-10H2,1-4H3.
What are the key properties of 6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol?
6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol has a molecular weight of 249.36 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]pyridin-3-ol is sourced from PubChem (CID 82981269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).