2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine

C14H23N3 — CID 115039853

IUPAC2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine
SMILESc1n[nH]c(CC2CCCCN2)c1C1CCCC1
InChIInChI=1S/C14H23N3/c1-2-6-11(5-1)13-10-16-17-14(13)9-12-7-3-4-8-15-12/h10-12,15H,1-9H2,(H,16,17)
InChIKeyWXOVCSQKIKBVAO-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.75
Rot. Bonds3

About 2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine

2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine (PubChem CID 115039853) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine.

Molecular Properties

Compound Name2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine
PubChem CID115039853
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine
SMILESc1n[nH]c(CC2CCCCN2)c1C1CCCC1
InChIInChI=1S/C14H23N3/c1-2-6-11(5-1)13-10-16-17-14(13)9-12-7-3-4-8-15-12/h10-12,15H,1-9H2,(H,16,17)
InChIKeyWXOVCSQKIKBVAO-UHFFFAOYSA-N
XLogP2.75
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-cycloheptyl-1H-pyrazol-5-yl)acetic acid
CID 105423374
2-[(4-cyclopropyl-1-methylpyrazol-5-yl)methyl]piperidine
CID 115031695
4-cycloheptyl-5-(pyrrolidin-2-ylmethyl)-1,2-oxazole
CID 115054022
4-(2-methylphenyl)-5-(pyrrolidin-2-ylmethyl)-1H-pyrazole
CID 115053743
2-[(2-cyclopropylphenyl)methyl]piperidine
CID 138039409
2-(1H-pyrazol-5-ylmethyl)piperidine
CID 83845818
5-cyclopropyl-2-(piperidin-2-ylmethyl)-1,3-thiazole
CID 115033672
5-cyclobutyl-2-(pyrrolidin-2-ylmethyl)-1H-pyrimidin-6-one
CID 84696945
5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
CID 84657560
4-cyclobutyl-5-pyrrolidin-2-yl-1H-pyrazole
CID 115018789
2-chloro-N-[(4-cyclobutyl-1H-pyrazol-5-yl)methyl]acetamide
CID 166431958
2-[(3-bromo-4-cyclopropylphenyl)methyl]piperidine
CID 117474630

Frequently Asked Questions

What is the IUPAC name of 2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine?
The IUPAC name of 2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine (CID 115039853) is 2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine.
What is the SMILES notation for 2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine?
The canonical SMILES for 2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine is c1n[nH]c(CC2CCCCN2)c1C1CCCC1.
What is the InChIKey of 2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine?
The InChIKey is WXOVCSQKIKBVAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-2-6-11(5-1)13-10-16-17-14(13)9-12-7-3-4-8-15-12/h10-12,15H,1-9H2,(H,16,17).
What are the key properties of 2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine?
2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine has a molecular weight of 233.36 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-cyclopentyl-1H-pyrazol-5-yl)methyl]piperidine is sourced from PubChem (CID 115039853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).