5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide

C15H26N4O2 — CID 118790739

IUPAC5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide
SMILESCCc1[nH]ncc1C(=O)NCCCOC1CCN(C)CC1
InChIInChI=1S/C15H26N4O2/c1-3-14-13(11-17-18-14)15(20)16-7-4-10-21-12-5-8-19(2)9-6-12/h11-12H,3-10H2,1-2H3,(H,16,20)(H,17,18)
InChIKeyGLCTXWZZUJLSOW-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.20
Rot. Bonds7

About 5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide

5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide (PubChem CID 118790739) has the molecular formula C15H26N4O2 and a molecular weight of 294.40 g/mol. Its IUPAC name is 5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide
PubChem CID118790739
Molecular FormulaC15H26N4O2
Molecular Weight294.40 g/mol
Exact Mass294.21
IUPAC Name5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide
SMILESCCc1[nH]ncc1C(=O)NCCCOC1CCN(C)CC1
InChIInChI=1S/C15H26N4O2/c1-3-14-13(11-17-18-14)15(20)16-7-4-10-21-12-5-8-19(2)9-6-12/h11-12H,3-10H2,1-2H3,(H,16,20)(H,17,18)
InChIKeyGLCTXWZZUJLSOW-UHFFFAOYSA-N
XLogP1.20
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(cyclopropylmethoxy)propyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 47078276
2-(2-chloro-6-fluorophenyl)-N-[3-(1-methylpiperidin-4-yl)oxypropyl]acetamide
CID 91792907
3,5-dimethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-4H-1,2-oxazole-5-carboxamide
CID 122569135
2-(1-methylpiperidin-2-yl)-N-[3-(1-methylpiperidin-4-yl)oxypropyl]acetamide
CID 122565628
N-(5-ethyl-1H-pyrazol-4-yl)-1-methylpiperidin-4-amine
CID 155225219
2-(dimethylcarbamoylamino)-N-[3-(1-methylpiperidin-4-yl)oxypropyl]acetamide
CID 122564451
N-methyl-3-(1-methylpiperidin-4-yl)oxypropan-1-amine
CID 62442293
N-(3-cyclohexyloxypropyl)-3-methylimidazole-4-carboxamide
CID 122562458
5-ethyl-N-[2-(2-fluorophenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 72930885
formic acid;1-methyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]azepane-2-carboxamide
CID 154912664
N-[3-(4-aminocyclohexyl)oxypropyl]-1-methylpyrazole-3-carboxamide
CID 103120763
5-(3-cyclopentyloxypropylcarbamoyl)-2-ethylfuran-3-carboxylic acid
CID 120822323

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide (CID 118790739) is 5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide is CCc1[nH]ncc1C(=O)NCCCOC1CCN(C)CC1.
What is the InChIKey of 5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide?
The InChIKey is GLCTXWZZUJLSOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O2/c1-3-14-13(11-17-18-14)15(20)16-7-4-10-21-12-5-8-19(2)9-6-12/h11-12H,3-10H2,1-2H3,(H,16,20)(H,17,18).
What are the key properties of 5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide?
5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide has a molecular weight of 294.40 g/mol, XLogP of 1.20, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[3-(1-methylpiperidin-4-yl)oxypropyl]-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 118790739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).