1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine

C11H21N3 — CID 143811923

IUPAC1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine
SMILESCC1=NN(C)CC1CN1CCCCC1
InChIInChI=1S/C11H21N3/c1-10-11(8-13(2)12-10)9-14-6-4-3-5-7-14/h11H,3-9H2,1-2H3
InChIKeyUULWCDOXDBOCMH-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.41
Rot. Bonds2

About 1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine

1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine (PubChem CID 143811923) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine.

Molecular Properties

Compound Name1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine
PubChem CID143811923
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine
SMILESCC1=NN(C)CC1CN1CCCCC1
InChIInChI=1S/C11H21N3/c1-10-11(8-13(2)12-10)9-14-6-4-3-5-7-14/h11H,3-9H2,1-2H3
InChIKeyUULWCDOXDBOCMH-UHFFFAOYSA-N
XLogP1.41
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 130548358
3-(azepan-1-ylmethyl)-1-methylazocane
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CID 91300985
5-ethynyl-1-methyl-3-(piperidin-1-ylmethyl)pyrrolidin-2-one
CID 141126900
2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-one
CID 62615095
2,2-dimethyl-5-(piperidin-1-ylmethyl)cyclopentan-1-one
CID 79866261
2-[[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]methyl]cyclohexan-1-one
CID 63007742
1-methyl-3-(pyrrolidin-1-ylmethyl)piperidine
CID 19028453
2,7-dimethyl-3,4,5,6-tetrahydrodiazepine
CID 59165083
(4S)-2-(3,4-dichlorophenyl)-5-methyl-4-(piperidin-1-ylmethyl)-4H-pyrazol-3-one
CID 40600379
2-(azetidin-1-ylmethyl)-4-ethylcyclohexan-1-one
CID 130548344
1-[(3-methylcyclobutyl)methyl]piperidine
CID 120999950

Frequently Asked Questions

What is the IUPAC name of 1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine?
The IUPAC name of 1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine (CID 143811923) is 1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine.
What is the SMILES notation for 1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine?
The canonical SMILES for 1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine is CC1=NN(C)CC1CN1CCCCC1.
What is the InChIKey of 1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine?
The InChIKey is UULWCDOXDBOCMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-10-11(8-13(2)12-10)9-14-6-4-3-5-7-14/h11H,3-9H2,1-2H3.
What are the key properties of 1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine?
1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine has a molecular weight of 195.31 g/mol, XLogP of 1.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,5-dimethyl-3,4-dihydropyrazol-4-yl)methyl]piperidine is sourced from PubChem (CID 143811923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).