1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide

C15H26N4O — CID 56706392

IUPAC1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide
SMILESCCCN1CCCC(CNC(=O)c2ccn(CC)n2)C1
InChIInChI=1S/C15H26N4O/c1-3-8-18-9-5-6-13(12-18)11-16-15(20)14-7-10-19(4-2)17-14/h7,10,13H,3-6,8-9,11-12H2,1-2H3,(H,16,20)
InChIKeyWDLIFWIMYSPGKX-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.75
Rot. Bonds6

About 1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide

1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide (PubChem CID 56706392) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide
PubChem CID56706392
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide
SMILESCCCN1CCCC(CNC(=O)c2ccn(CC)n2)C1
InChIInChI=1S/C15H26N4O/c1-3-8-18-9-5-6-13(12-18)11-16-15(20)14-7-10-19(4-2)17-14/h7,10,13H,3-6,8-9,11-12H2,1-2H3,(H,16,20)
InChIKeyWDLIFWIMYSPGKX-UHFFFAOYSA-N
XLogP1.75
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-propylpiperidin-3-yl)methyl]pyrimidine-5-carboxamide
CID 118783160
3-methyl-4-oxo-N-[[(3R)-1-propylpiperidin-3-yl]methyl]phthalazine-1-carboxamide
CID 95231092
N-[[(3R)-1-propylpiperidin-3-yl]methyl]-4-sulfamoylbenzamide
CID 95215747
N,1-diethylpyrazole-3-carboxamide
CID 19262384
N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-1,5-dimethylindazole-3-carboxamide
CID 95227494
3-(butanoylamino)-N-[(1-propylpiperidin-3-yl)methyl]benzamide
CID 46984845
2-(5-methylpyrimidin-2-yl)sulfanyl-N-[(1-propylpiperidin-3-yl)methyl]acetamide
CID 23590438
2-[(3R)-1-(1-ethylpyrazole-3-carbonyl)piperidin-3-yl]-N-(oxan-4-ylmethyl)acetamide
CID 124990011
N-[[1-(2-hydroxyethyl)piperidin-3-yl]methyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 118795747
(1-ethylpyrazol-3-yl)-[(3S)-3-methylpiperidin-1-yl]methanone
CID 35763373
(2R)-4-(1-ethylpyrazole-3-carbonyl)-1-methyl-N-(oxan-4-ylmethyl)piperazine-2-carboxamide
CID 125026841
N'-(3-fluorophenyl)-N-[[(3R)-1-propylpiperidin-3-yl]methyl]oxamide
CID 95197793

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide?
The IUPAC name of 1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide (CID 56706392) is 1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide.
What is the SMILES notation for 1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide?
The canonical SMILES for 1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide is CCCN1CCCC(CNC(=O)c2ccn(CC)n2)C1.
What is the InChIKey of 1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide?
The InChIKey is WDLIFWIMYSPGKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-3-8-18-9-5-6-13(12-18)11-16-15(20)14-7-10-19(4-2)17-14/h7,10,13H,3-6,8-9,11-12H2,1-2H3,(H,16,20).
What are the key properties of 1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide?
1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 1.75, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(1-propylpiperidin-3-yl)methyl]pyrazole-3-carboxamide is sourced from PubChem (CID 56706392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).