N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride

C11H20Cl2N4O — CID 119424500

IUPACN-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride
SMILESCC(C(=O)NC1CCCNC1)n1cccn1.Cl.Cl
InChIInChI=1S/C11H18N4O.2ClH/c1-9(15-7-3-6-13-15)11(16)14-10-4-2-5-12-8-10;;/h3,6-7,9-10,12H,2,4-5,8H2,1H3,(H,14,16);2*1H
InChIKeyXQEUDNGLWXOYOC-UHFFFAOYSA-N
MW295.21 g/mol
LogP1.16
Rot. Bonds3

About N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride

N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride (PubChem CID 119424500) has the molecular formula C11H20Cl2N4O and a molecular weight of 295.21 g/mol. Its IUPAC name is N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride.

Molecular Properties

Compound NameN-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride
PubChem CID119424500
Molecular FormulaC11H20Cl2N4O
Molecular Weight295.21 g/mol
Exact Mass294.10
IUPAC NameN-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride
SMILESCC(C(=O)NC1CCCNC1)n1cccn1.Cl.Cl
InChIInChI=1S/C11H18N4O.2ClH/c1-9(15-7-3-6-13-15)11(16)14-10-4-2-5-12-8-10;;/h3,6-7,9-10,12H,2,4-5,8H2,1H3,(H,14,16);2*1H
InChIKeyXQEUDNGLWXOYOC-UHFFFAOYSA-N
XLogP1.16
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.21
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-2-pyrazol-1-ylpropanamide
CID 47156273
2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride
CID 53256452
4-[[(2R)-2-pyrazol-1-ylpropanoyl]amino]cyclohexane-1-carboxylic acid
CID 93329821
3-[[(2S)-2-pyrazol-1-ylpropanoyl]amino]cyclobutane-1-carboxylic acid
CID 126439290
N-[(4S)-4-methoxypyrrolidin-3-yl]-2-pyrazol-1-ylpropanamide
CID 43593952
N-methyl-N-[2-oxo-2-(piperidin-3-ylmethylamino)ethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride
CID 119463887
methyl 4-(2-pyrazol-1-ylpropanoylamino)cyclohexane-1-carboxylate
CID 115617096
N-[2-(cycloheptylamino)ethyl]-2-pyrazol-1-ylpropanamide
CID 81424644
2-methoxy-N-[(3S)-piperidin-3-yl]propanamide
CID 103866505
N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride
CID 119295241
3,3,3-trifluoro-2-methyl-N-piperidin-3-ylpropanamide
CID 119424701
N-[(3,3-dimethylpiperidin-2-yl)methyl]-2-pyrazol-1-ylpropanamide;dihydrochloride
CID 120670877

Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride?
The IUPAC name of N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride (CID 119424500) is N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride.
What is the SMILES notation for N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride?
The canonical SMILES for N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride is CC(C(=O)NC1CCCNC1)n1cccn1.Cl.Cl.
What is the InChIKey of N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride?
The InChIKey is XQEUDNGLWXOYOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O.2ClH/c1-9(15-7-3-6-13-15)11(16)14-10-4-2-5-12-8-10;;/h3,6-7,9-10,12H,2,4-5,8H2,1H3,(H,14,16);2*1H.
What are the key properties of N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride?
N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride has a molecular weight of 295.21 g/mol, XLogP of 1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride is sourced from PubChem (CID 119424500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).