2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide

C11H20N4O — CID 62836683

IUPAC2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide
SMILESCCNC(C)(C)C(=O)NCc1cnn(C)c1
InChIInChI=1S/C11H20N4O/c1-5-13-11(2,3)10(16)12-6-9-7-14-15(4)8-9/h7-8,13H,5-6H2,1-4H3,(H,12,16)
InChIKeyZNUVKCOUIBDTFA-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.42
Rot. Bonds5

About 2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide

2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide (PubChem CID 62836683) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide.

Molecular Properties

Compound Name2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide
PubChem CID62836683
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide
SMILESCCNC(C)(C)C(=O)NCc1cnn(C)c1
InChIInChI=1S/C11H20N4O/c1-5-13-11(2,3)10(16)12-6-9-7-14-15(4)8-9/h7-8,13H,5-6H2,1-4H3,(H,12,16)
InChIKeyZNUVKCOUIBDTFA-UHFFFAOYSA-N
XLogP0.42
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-3-[(1-methylpyrazol-4-yl)methylamino]-3-oxopropanoic acid
CID 82820912
2-(ethylamino)-2-methyl-N-[(1-phenylpyrazol-4-yl)methyl]propanamide
CID 62835939
2-(ethylamino)-2-methyl-N-(1-methylpyrazol-4-yl)propanamide
CID 62831574
2-methyl-2-[(1-methylpyrazol-4-yl)methylamino]butanoic acid
CID 78969503
2-(ethylamino)-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-2-methylpropanamide
CID 112669318
1-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-4-carboxamide
CID 19474553
2-(ethylamino)-2-methyl-N-[(4-methylphenyl)methyl]propanamide
CID 62831732
2,2,3-trimethyl-3-[(1-methylpyrazol-4-yl)methylamino]butanoic acid
CID 65265166
1-(5-hydroxy-4,4-dimethylpentyl)-3-[(1-methylpyrazol-4-yl)methyl]urea
CID 111505194
2-amino-N-[(1-methylpyrazol-4-yl)methyl]butanamide
CID 61349106
2-methyl-2-[methyl-[(1-methylpyrazol-4-yl)methylcarbamoyl]amino]propanoic acid
CID 62820296
2,2-dimethyl-4-[(1-methylpyrazol-4-yl)methylcarbamoylamino]-4-oxobutanoic acid
CID 65301891

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
The IUPAC name of 2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide (CID 62836683) is 2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide.
What is the SMILES notation for 2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
The canonical SMILES for 2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide is CCNC(C)(C)C(=O)NCc1cnn(C)c1.
What is the InChIKey of 2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
The InChIKey is ZNUVKCOUIBDTFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-5-13-11(2,3)10(16)12-6-9-7-14-15(4)8-9/h7-8,13H,5-6H2,1-4H3,(H,12,16).
What are the key properties of 2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide has a molecular weight of 224.31 g/mol, XLogP of 0.42, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide is sourced from PubChem (CID 62836683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).