1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine

C15H25N3 — CID 786815

IUPAC1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine
SMILESc1c(C2CCCCC2)n[nH]c1CN1CCCCC1
InChIInChI=1S/C15H25N3/c1-3-7-13(8-4-1)15-11-14(16-17-15)12-18-9-5-2-6-10-18/h11,13H,1-10,12H2,(H,16,17)
InChIKeyXKNXSIOHXSOBAB-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.44
Rot. Bonds3

About 1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine

1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine (PubChem CID 786815) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine.

Molecular Properties

Compound Name1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine
PubChem CID786815
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine
SMILESc1c(C2CCCCC2)n[nH]c1CN1CCCCC1
InChIInChI=1S/C15H25N3/c1-3-7-13(8-4-1)15-11-14(16-17-15)12-18-9-5-2-6-10-18/h11,13H,1-10,12H2,(H,16,17)
InChIKeyXKNXSIOHXSOBAB-UHFFFAOYSA-N
XLogP3.44
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Benzyl-4-(5-methyl-1H-pyrazol-3-yl)-piperidine
CID 10587140
((5-tert-butyl-1H-pyrazol-3-yl)methyl)(methyl)amine
CID 44236865
1-(5-Cyclopropyl-1H-pyrazol-3-YL)-N-methylmethanamine
CID 44236867
3-[3-(propan-2-yl)-1H-pyrazol-5-yl]piperidine
CID 71695345
1-isobutyl-4-{1-[(3-methyl-1H-pyrazol-5-yl)methyl]-3-pyrrolidinyl}piperidine
CID 45194228
1-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-(3-isopropyl-1H-pyrazol-5-yl)piperidine
CID 56710882
1-isobutyl-N-[1-methyl-2-(3-methyl-1H-pyrazol-5-yl)ethyl]piperidin-4-amine
CID 56712928
N,2,2,6,6-Pentamethyl-N-[(5-propyl-1H-pyrazol-3-YL)methyl]piperidin-4-amine
CID 56748665
2-(4-methylpiperazin-1-yl)-1-[3-(5-methyl-1H-pyrazol-3-yl)piperidin-1-yl]ethanone
CID 71926769
N-[3-[3-(5-methyl-1H-pyrazol-3-yl)piperidin-1-yl]propyl]methanesulfonamide
CID 71926947
5-[1-(cyclohexylmethyl)pyrrolidin-2-yl]-1H-pyrazole
CID 110249240
4-(3-methyl-1H-pyrazol-5-yl)piperidine dihydrochloride
CID 71757999

Frequently Asked Questions

What is the IUPAC name of 1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine?
The IUPAC name of 1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine (CID 786815) is 1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine.
What is the SMILES notation for 1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine?
The canonical SMILES for 1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine is c1c(C2CCCCC2)n[nH]c1CN1CCCCC1.
What is the InChIKey of 1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine?
The InChIKey is XKNXSIOHXSOBAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-7-13(8-4-1)15-11-14(16-17-15)12-18-9-5-2-6-10-18/h11,13H,1-10,12H2,(H,16,17).
What are the key properties of 1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine?
1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine has a molecular weight of 247.39 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine is sourced from PubChem (CID 786815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).