6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid

C13H18N2O3 — CID 65471120

IUPAC6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid
SMILESCN1CCCCC1COc1ccc(C(=O)O)cn1
InChIInChI=1S/C13H18N2O3/c1-15-7-3-2-4-11(15)9-18-12-6-5-10(8-14-12)13(16)17/h5-6,8,11H,2-4,7,9H2,1H3,(H,16,17)
InChIKeyMEHIWKLUXQRWED-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.64
Rot. Bonds4

About 6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid

6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid (PubChem CID 65471120) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid
PubChem CID65471120
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid
SMILESCN1CCCCC1COc1ccc(C(=O)O)cn1
InChIInChI=1S/C13H18N2O3/c1-15-7-3-2-4-11(15)9-18-12-6-5-10(8-14-12)13(16)17/h5-6,8,11H,2-4,7,9H2,1H3,(H,16,17)
InChIKeyMEHIWKLUXQRWED-UHFFFAOYSA-N
XLogP1.64
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyridine-3-carboxylic acid
CID 61101138
6-(cyclopentylmethoxy)pyridine-3-carboxylic acid
CID 66324302
6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-sulfonamide
CID 112572780
2-chloro-6-[(1-methylpiperidin-2-yl)methoxy]pyridine-4-carboxylic acid
CID 65472831
3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine
CID 117063213
3-fluoro-4-[(1-methylpiperidin-2-yl)methoxy]benzoic acid
CID 65469618
4-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid
CID 81225049
[6-[(1-methylpiperidin-2-yl)methoxy]pyridazin-3-yl]methanol
CID 65467681
3-[(1-methylpiperidin-2-yl)methoxy]pyrazine-2-carboxylic acid
CID 65469620
2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine-4-carboxylic acid
CID 107554961
5-[(1-methylpiperidin-2-yl)methoxy]furan-2-carboxylic acid
CID 65472829
2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]pyridine
CID 141201313

Frequently Asked Questions

What is the IUPAC name of 6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid?
The IUPAC name of 6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid (CID 65471120) is 6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid is CN1CCCCC1COc1ccc(C(=O)O)cn1.
What is the InChIKey of 6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid?
The InChIKey is MEHIWKLUXQRWED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-15-7-3-2-4-11(15)9-18-12-6-5-10(8-14-12)13(16)17/h5-6,8,11H,2-4,7,9H2,1H3,(H,16,17).
What are the key properties of 6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid?
6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid has a molecular weight of 250.30 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid is sourced from PubChem (CID 65471120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).