N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine

C14H26N4 — CID 79714881

IUPACN-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine
SMILESCC(C)N(CCn1cccn1)CC1CCNCC1
InChIInChI=1S/C14H26N4/c1-13(2)17(10-11-18-9-3-6-16-18)12-14-4-7-15-8-5-14/h3,6,9,13-15H,4-5,7-8,10-12H2,1-2H3
InChIKeyYLVGWKWYOQPMGF-UHFFFAOYSA-N
MW250.39 g/mol
LogP1.59
Rot. Bonds6

About N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine

N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine (PubChem CID 79714881) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine.

Molecular Properties

Compound NameN-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine
PubChem CID79714881
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC NameN-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine
SMILESCC(C)N(CCn1cccn1)CC1CCNCC1
InChIInChI=1S/C14H26N4/c1-13(2)17(10-11-18-9-3-6-16-18)12-14-4-7-15-8-5-14/h3,6,9,13-15H,4-5,7-8,10-12H2,1-2H3
InChIKeyYLVGWKWYOQPMGF-UHFFFAOYSA-N
XLogP1.59
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-propyl-N-(2-pyrazol-1-ylethyl)piperidin-4-amine
CID 54960820
N-(piperidin-4-ylmethyl)-N-(pyrimidin-2-ylmethyl)propan-2-amine
CID 79714663
N-(2-ethoxyethyl)-N-(piperidin-4-ylmethyl)propan-2-amine
CID 79713909
2-[4-[[piperidin-4-ylmethyl(propan-2-yl)amino]methyl]pyrazol-1-yl]ethanol
CID 79715642
2-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylbutan-1-amine
CID 79716141
N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrazol-1-ylpropanamide
CID 106629180
N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine
CID 63266461
N-(piperidin-4-ylmethyl)-N-(2-thiophen-2-ylethyl)propan-2-amine
CID 79713906
(2R)-1-[piperidin-4-ylmethyl(propan-2-yl)amino]propan-2-ol
CID 106933609
1-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylimidazol-2-amine
CID 79719989
3-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)-N-propan-2-ylpropan-1-amine
CID 103411120
N-(piperidin-3-ylmethyl)-N-propan-2-yl-2-pyrazol-1-ylacetamide
CID 106629183

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine?
The IUPAC name of N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine (CID 79714881) is N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine.
What is the SMILES notation for N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine?
The canonical SMILES for N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine is CC(C)N(CCn1cccn1)CC1CCNCC1.
What is the InChIKey of N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine?
The InChIKey is YLVGWKWYOQPMGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-13(2)17(10-11-18-9-3-6-16-18)12-14-4-7-15-8-5-14/h3,6,9,13-15H,4-5,7-8,10-12H2,1-2H3.
What are the key properties of N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine?
N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine has a molecular weight of 250.39 g/mol, XLogP of 1.59, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-4-ylmethyl)-N-(2-pyrazol-1-ylethyl)propan-2-amine is sourced from PubChem (CID 79714881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).