N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide

C14H24N4O2 — CID 56722291

IUPACN-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide
SMILESCC(C)n1cc(C(=O)NCCC2CN(C)CCO2)cn1
InChIInChI=1S/C14H24N4O2/c1-11(2)18-9-12(8-16-18)14(19)15-5-4-13-10-17(3)6-7-20-13/h8-9,11,13H,4-7,10H2,1-3H3,(H,15,19)
InChIKeyKELLRCWIEUPMSO-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.91
Rot. Bonds5

About N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide

N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide (PubChem CID 56722291) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide
PubChem CID56722291
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC NameN-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide
SMILESCC(C)n1cc(C(=O)NCCC2CN(C)CCO2)cn1
InChIInChI=1S/C14H24N4O2/c1-11(2)18-9-12(8-16-18)14(19)15-5-4-13-10-17(3)6-7-20-13/h8-9,11,13H,4-7,10H2,1-3H3,(H,15,19)
InChIKeyKELLRCWIEUPMSO-UHFFFAOYSA-N
XLogP0.91
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,1-diethyl-N-[3-(4-morpholinyl)propyl]-1H-pyrazole-4-carboxamide trifluoroacetate
CID 28392279
(1-Ethylpyrazol-4-yl)-morpholin-4-ylmethanone
CID 35762493
N-methyl-4-[(1-methylpyrazole-4-carbonyl)amino]piperidine-1-carboxamide
CID 45831942
1-methyl-N-[1-[2-(oxolan-2-yl)acetyl]piperidin-4-yl]pyrazole-4-carboxamide
CID 47043527
N-(3-methoxypropyl)-4-[[(1-methylpyrazole-4-carbonyl)amino]methyl]piperidine-1-carboxamide
CID 53544420
N-(2-acetamidoethyl)-2-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]acetamide
CID 53582922
(2S)-2-methyl-1-(1-methyl-1H-pyrazole-4-carbonyl)piperazine dihydrochloride
CID 170913622
[4-(1-Methylpiperidin-4-yl)oxypiperidin-1-yl]-(1-methylpyrazol-4-yl)methanone
CID 91916385
1-methyl-N-[1-(3-sulfanylpropanoyl)piperidin-4-yl]pyrazole-4-carboxamide
CID 177680747
N-[1-(3-amino-3-oxopropyl)piperidin-4-yl]-1-methylpyrazole-4-carboxamide
CID 47220435
N,N-bis(2-methoxyethyl)-1-methylpyrazole-4-carboxamide
CID 51073398
N-(1-methoxypropan-2-yl)-1-methylpyrazole-4-carboxamide
CID 53532136

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide?
The IUPAC name of N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide (CID 56722291) is N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide?
The canonical SMILES for N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide is CC(C)n1cc(C(=O)NCCC2CN(C)CCO2)cn1.
What is the InChIKey of N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide?
The InChIKey is KELLRCWIEUPMSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-11(2)18-9-12(8-16-18)14(19)15-5-4-13-10-17(3)6-7-20-13/h8-9,11,13H,4-7,10H2,1-3H3,(H,15,19).
What are the key properties of N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide?
N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 0.91, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylmorpholin-2-yl)ethyl]-1-propan-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 56722291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).