4-cyclohexyloxypyridine-2-carboxylic acid

C12H15NO3 — CID 43142909

IUPAC4-cyclohexyloxypyridine-2-carboxylic acid
SMILESO=C(O)c1cc(OC2CCCCC2)ccn1
InChIInChI=1S/C12H15NO3/c14-12(15)11-8-10(6-7-13-11)16-9-4-2-1-3-5-9/h6-9H,1-5H2,(H,14,15)
InChIKeyVHLJFCNRRVZINW-UHFFFAOYSA-N
MW221.26 g/mol
LogP2.49
Rot. Bonds3

About 4-cyclohexyloxypyridine-2-carboxylic acid

4-cyclohexyloxypyridine-2-carboxylic acid (PubChem CID 43142909) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is 4-cyclohexyloxypyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-cyclohexyloxypyridine-2-carboxylic acid
PubChem CID43142909
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC Name4-cyclohexyloxypyridine-2-carboxylic acid
SMILESO=C(O)c1cc(OC2CCCCC2)ccn1
InChIInChI=1S/C12H15NO3/c14-12(15)11-8-10(6-7-13-11)16-9-4-2-1-3-5-9/h6-9H,1-5H2,(H,14,15)
InChIKeyVHLJFCNRRVZINW-UHFFFAOYSA-N
XLogP2.49
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(1S,3R)-3-hydroxycyclopentyl]oxypyridine-2-carboxylic acid
CID 139349633
4-(oxolan-3-yloxy)pyridine-2-carboxylic acid
CID 63556832
4-(cyclohexylmethoxy)pyridine-2-carboxylic acid
CID 62382036
5-cycloheptyloxypyridine-2-carboxylic acid
CID 115491140
2-(4-cyclobutyloxy-2-pyridinyl)acetic acid
CID 118627309
4-(3,3,5-trimethylcyclohexyl)oxypyridine-2-carboxylic acid
CID 43326039
4-(cyclopentyloxymethyl)pyridine-2-carboxylic acid
CID 63885745
methyl N-[1-(4-cyclopentyloxypyridine-2-carbonyl)pyrrolidin-3-yl]carbamate
CID 166296354
(4-cyclopentyloxy-2-pyridinyl)methanol
CID 61258192
4-[1-(cyclopentylcarbamoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122257046
4-cyclobutyloxy-2-methylpyridine
CID 70661228
4-[[2-(cyclopentylamino)-1,3-benzoxazol-6-yl]oxy]pyridine-2-carboxylic acid
CID 142780749

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyloxypyridine-2-carboxylic acid?
The IUPAC name of 4-cyclohexyloxypyridine-2-carboxylic acid (CID 43142909) is 4-cyclohexyloxypyridine-2-carboxylic acid.
What is the SMILES notation for 4-cyclohexyloxypyridine-2-carboxylic acid?
The canonical SMILES for 4-cyclohexyloxypyridine-2-carboxylic acid is O=C(O)c1cc(OC2CCCCC2)ccn1.
What is the InChIKey of 4-cyclohexyloxypyridine-2-carboxylic acid?
The InChIKey is VHLJFCNRRVZINW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c14-12(15)11-8-10(6-7-13-11)16-9-4-2-1-3-5-9/h6-9H,1-5H2,(H,14,15).
What are the key properties of 4-cyclohexyloxypyridine-2-carboxylic acid?
4-cyclohexyloxypyridine-2-carboxylic acid has a molecular weight of 221.26 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyloxypyridine-2-carboxylic acid is sourced from PubChem (CID 43142909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).