1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid

C13H23NO3 — CID 115055583

IUPAC1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid
SMILESO=C(O)C1(O)CCN(C2CCCCCC2)CC1
InChIInChI=1S/C13H23NO3/c15-12(16)13(17)7-9-14(10-8-13)11-5-3-1-2-4-6-11/h11,17H,1-10H2,(H,15,16)
InChIKeyNBUNSYMMOKBUQV-UHFFFAOYSA-N
MW241.33 g/mol
LogP1.62
Rot. Bonds2

About 1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid

1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid (PubChem CID 115055583) has the molecular formula C13H23NO3 and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid
PubChem CID115055583
Molecular FormulaC13H23NO3
Molecular Weight241.33 g/mol
Exact Mass241.17
IUPAC Name1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid
SMILESO=C(O)C1(O)CCN(C2CCCCCC2)CC1
InChIInChI=1S/C13H23NO3/c15-12(16)13(17)7-9-14(10-8-13)11-5-3-1-2-4-6-11/h11,17H,1-10H2,(H,15,16)
InChIKeyNBUNSYMMOKBUQV-UHFFFAOYSA-N
XLogP1.62
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-1-piperidin-4-ylazepane-4-carboxylic acid
CID 115055711
1-(cyclohexanecarbonyl)-4-hydroxypiperidine-4-carboxylic acid
CID 119250882
1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid
CID 63126612
3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid
CID 115028740
1,4-dicyclopentylpiperazine;oxalic acid
CID 17369822
2-hydroxy-3,5,6,7,8,8a-hexahydro-1H-indolizine-2-carboxylic acid
CID 83906916
1-(1-cyclopentylpiperidin-4-yl)azepane;oxalic acid
CID 17369286
1-(4-cyclopentylpiperazine-1-carbonyl)cyclopropane-1-carboxylic acid
CID 62369000
2-(1-cyclopentyl-4-methylpiperidin-4-yl)acetic acid
CID 117013254
1-cyclobutyl-4-(difluoromethyl)piperidine-4-carboxylic acid
CID 115039380
1-cyclopentyl-4-methylazepan-4-ol
CID 107408390
(1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol
CID 86283742

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid?
The IUPAC name of 1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid (CID 115055583) is 1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid.
What is the SMILES notation for 1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid?
The canonical SMILES for 1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid is O=C(O)C1(O)CCN(C2CCCCCC2)CC1.
What is the InChIKey of 1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid?
The InChIKey is NBUNSYMMOKBUQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3/c15-12(16)13(17)7-9-14(10-8-13)11-5-3-1-2-4-6-11/h11,17H,1-10H2,(H,15,16).
What are the key properties of 1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid?
1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid has a molecular weight of 241.33 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid is sourced from PubChem (CID 115055583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).