1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine

C14H24N4 — CID 63255576

IUPAC1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine
SMILESCn1nccc1CN1CCC(C2CCCN2)CC1
InChIInChI=1S/C14H24N4/c1-17-13(4-8-16-17)11-18-9-5-12(6-10-18)14-3-2-7-15-14/h4,8,12,14-15H,2-3,5-7,9-11H2,1H3
InChIKeyDRHPBDMZLREZHK-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.38
Rot. Bonds3

About 1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine

1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine (PubChem CID 63255576) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine.

Molecular Properties

Compound Name1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine
PubChem CID63255576
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine
SMILESCn1nccc1CN1CCC(C2CCCN2)CC1
InChIInChI=1S/C14H24N4/c1-17-13(4-8-16-17)11-18-9-5-12(6-10-18)14-3-2-7-15-14/h4,8,12,14-15H,2-3,5-7,9-11H2,1H3
InChIKeyDRHPBDMZLREZHK-UHFFFAOYSA-N
XLogP1.38
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2-methylpyrazol-3-yl)methyl]-2-pyrrolidin-2-ylpiperidine
CID 63256578
6-[(2-ethylpyrazol-3-yl)methyl]-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102678285
2-methyl-5-[(4-pyrrolidin-2-ylpiperidin-1-yl)methyl]-1,3,4-oxadiazole
CID 63259094
1-[(5-bromothiophen-2-yl)methyl]-4-pyrrolidin-2-ylpiperidine
CID 63255802
3-methyl-1-[(2-methylpyrazol-3-yl)methyl]piperidine
CID 129199078
1-(2-piperidin-1-ylethyl)-4-pyrrolidin-2-ylpiperidine
CID 63259095
6-[(1-methylpyrazol-3-yl)methyl]-2,3,4,4a,5,7,8,8a-octahydro-1H-1,6-naphthyridine
CID 82866010
1-(1,3-benzodioxol-5-ylmethyl)-4-pyrrolidin-2-ylpiperidine
CID 63256117
2-[2-(2-methylpyrazol-3-yl)ethyl]azepane
CID 103015057
3-propyl-5-[(4-pyrrolidin-2-ylpiperidin-1-yl)methyl]-1,2,4-oxadiazole
CID 63257101
3-[1-[(2-methylpyrazol-3-yl)methyl]piperidin-4-yl]oxypropanoic acid
CID 65066006
1-[(1-propyltetrazol-5-yl)methyl]-4-pyrrolidin-2-ylpiperidine
CID 63257316

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine?
The IUPAC name of 1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine (CID 63255576) is 1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine.
What is the SMILES notation for 1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine?
The canonical SMILES for 1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine is Cn1nccc1CN1CCC(C2CCCN2)CC1.
What is the InChIKey of 1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine?
The InChIKey is DRHPBDMZLREZHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-17-13(4-8-16-17)11-18-9-5-12(6-10-18)14-3-2-7-15-14/h4,8,12,14-15H,2-3,5-7,9-11H2,1H3.
What are the key properties of 1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine?
1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine has a molecular weight of 248.37 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylpyrazol-3-yl)methyl]-4-pyrrolidin-2-ylpiperidine is sourced from PubChem (CID 63255576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).