4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide

C13H22N4O2 — CID 71986184

IUPAC4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide
SMILESCC(C)CCC(=O)NCC(=O)N(C)c1cnn(C)c1
InChIInChI=1S/C13H22N4O2/c1-10(2)5-6-12(18)14-8-13(19)17(4)11-7-15-16(3)9-11/h7,9-10H,5-6,8H2,1-4H3,(H,14,18)
InChIKeyMZFDSUXPVXHLOM-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.94
Rot. Bonds6

About 4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide

4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide (PubChem CID 71986184) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide.

Molecular Properties

Compound Name4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide
PubChem CID71986184
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide
SMILESCC(C)CCC(=O)NCC(=O)N(C)c1cnn(C)c1
InChIInChI=1S/C13H22N4O2/c1-10(2)5-6-12(18)14-8-13(19)17(4)11-7-15-16(3)9-11/h7,9-10H,5-6,8H2,1-4H3,(H,14,18)
InChIKeyMZFDSUXPVXHLOM-UHFFFAOYSA-N
XLogP0.94
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide?
The IUPAC name of 4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide (CID 71986184) is 4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide.
What is the SMILES notation for 4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide?
The canonical SMILES for 4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide is CC(C)CCC(=O)NCC(=O)N(C)c1cnn(C)c1.
What is the InChIKey of 4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide?
The InChIKey is MZFDSUXPVXHLOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-10(2)5-6-12(18)14-8-13(19)17(4)11-7-15-16(3)9-11/h7,9-10H,5-6,8H2,1-4H3,(H,14,18).
What are the key properties of 4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide?
4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide has a molecular weight of 266.34 g/mol, XLogP of 0.94, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[2-[methyl-(1-methylpyrazol-4-yl)amino]-2-oxoethyl]pentanamide is sourced from PubChem (CID 71986184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).