2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide

C12H18N4O3 — CID 146126134

IUPAC2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
SMILESCc1cnn(CC(=O)NCC(=O)N2CCOCC2)c1
InChIInChI=1S/C12H18N4O3/c1-10-6-14-16(8-10)9-11(17)13-7-12(18)15-2-4-19-5-3-15/h6,8H,2-5,7,9H2,1H3,(H,13,17)
InChIKeyCLPKRNDKASROHT-UHFFFAOYSA-N
MW266.30 g/mol
LogP-0.83
Rot. Bonds4

About 2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide

2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide (PubChem CID 146126134) has the molecular formula C12H18N4O3 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide.

Molecular Properties

Compound Name2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
PubChem CID146126134
Molecular FormulaC12H18N4O3
Molecular Weight266.30 g/mol
Exact Mass266.14
IUPAC Name2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
SMILESCc1cnn(CC(=O)NCC(=O)N2CCOCC2)c1
InChIInChI=1S/C12H18N4O3/c1-10-6-14-16(8-10)9-11(17)13-7-12(18)15-2-4-19-5-3-15/h6,8H,2-5,7,9H2,1H3,(H,13,17)
InChIKeyCLPKRNDKASROHT-UHFFFAOYSA-N
XLogP-0.83
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 5-0.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methylpyrazol-1-yl)-N-(3-morpholin-4-ylpropyl)acetamide
CID 19526449
N-[2-(4-methylpyrazol-1-yl)ethyl]morpholine-4-carboxamide
CID 113238079
2-(4-methylphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 110712382
2-morpholin-4-yl-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 86019043
1-[(2R)-2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-2-(4-methylpyrazol-1-yl)ethanone
CID 92632639
methyl 1-(2-morpholin-4-yl-2-oxoethyl)pyrazole-4-carboxylate
CID 171315068
1-(2-morpholin-4-yl-2-oxoethyl)pyrazole-4-carboxylic acid
CID 19622291
1-[(3R,4R)-3-ethyl-4-morpholin-4-ylpyrrolidin-1-yl]-2-(4-methylpyrazol-1-yl)ethanone
CID 97026533
2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone
CID 79778249
2-(4-ethylphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 75445681
(2R)-2-[(2R)-2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]-1-morpholin-4-ylpropan-1-one
CID 98765633
2-(4-iodopyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)propanamide
CID 171132676

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide?
The IUPAC name of 2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide (CID 146126134) is 2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide.
What is the SMILES notation for 2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide?
The canonical SMILES for 2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide is Cc1cnn(CC(=O)NCC(=O)N2CCOCC2)c1.
What is the InChIKey of 2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide?
The InChIKey is CLPKRNDKASROHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O3/c1-10-6-14-16(8-10)9-11(17)13-7-12(18)15-2-4-19-5-3-15/h6,8H,2-5,7,9H2,1H3,(H,13,17).
What are the key properties of 2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide?
2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide has a molecular weight of 266.30 g/mol, XLogP of -0.83, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpyrazol-1-yl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide is sourced from PubChem (CID 146126134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).