1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine

C15H25N3 — CID 73440511

IUPAC1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine
SMILESCn1nccc1CC1CCN(C2CCCC2)CC1
InChIInChI=1S/C15H25N3/c1-17-15(6-9-16-17)12-13-7-10-18(11-8-13)14-4-2-3-5-14/h6,9,13-14H,2-5,7-8,10-12H2,1H3
InChIKeyRTLINIWNKCUEHH-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.62
Rot. Bonds3

About 1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine

1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine (PubChem CID 73440511) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine.

Molecular Properties

Compound Name1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine
PubChem CID73440511
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine
SMILESCn1nccc1CC1CCN(C2CCCC2)CC1
InChIInChI=1S/C15H25N3/c1-17-15(6-9-16-17)12-13-7-10-18(11-8-13)14-4-2-3-5-14/h6,9,13-14H,2-5,7-8,10-12H2,1H3
InChIKeyRTLINIWNKCUEHH-UHFFFAOYSA-N
XLogP2.62
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine?
The IUPAC name of 1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine (CID 73440511) is 1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine.
What is the SMILES notation for 1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine?
The canonical SMILES for 1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine is Cn1nccc1CC1CCN(C2CCCC2)CC1.
What is the InChIKey of 1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine?
The InChIKey is RTLINIWNKCUEHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-17-15(6-9-16-17)12-13-7-10-18(11-8-13)14-4-2-3-5-14/h6,9,13-14H,2-5,7-8,10-12H2,1H3.
What are the key properties of 1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine?
1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine has a molecular weight of 247.39 g/mol, XLogP of 2.62, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-[(2-methylpyrazol-3-yl)methyl]piperidine is sourced from PubChem (CID 73440511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).