N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide

C16H28N4O2 — CID 30476207

IUPACN-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
SMILESCc1nn(C)c(C)c1CC(=O)NCC(C)(C)N1CCOCC1
InChIInChI=1S/C16H28N4O2/c1-12-14(13(2)19(5)18-12)10-15(21)17-11-16(3,4)20-6-8-22-9-7-20/h6-11H2,1-5H3,(H,17,21)
InChIKeyYRLZVKJRPVFEQJ-UHFFFAOYSA-N
MW308.43 g/mol
LogP0.81
Rot. Bonds5

About N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide

N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide (PubChem CID 30476207) has the molecular formula C16H28N4O2 and a molecular weight of 308.43 g/mol. Its IUPAC name is N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
PubChem CID30476207
Molecular FormulaC16H28N4O2
Molecular Weight308.43 g/mol
Exact Mass308.22
IUPAC NameN-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
SMILESCc1nn(C)c(C)c1CC(=O)NCC(C)(C)N1CCOCC1
InChIInChI=1S/C16H28N4O2/c1-12-14(13(2)19(5)18-12)10-15(21)17-11-16(3,4)20-6-8-22-9-7-20/h6-11H2,1-5H3,(H,17,21)
InChIKeyYRLZVKJRPVFEQJ-UHFFFAOYSA-N
XLogP0.81
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(1-isobutyl-3-oxo-2-piperazinyl)acetamide
CID 16190571
2-[1-(2,2-dimethylpropyl)-3-oxopiperazin-2-yl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]acetamide
CID 16191037
N-[[1-(dimethylamino)cycloheptyl]methyl]-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 39935160
N-[1-[2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]acetyl]piperidin-3-yl]methanesulfonamide
CID 45885370
N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 47020141
N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 51097118
4-[[[2-(1,3,5-Trimethylpyrazol-4-yl)acetyl]amino]methyl]oxane-4-carboxamide
CID 56808466
N~3~-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-1,3-piperidinedicarboxamide
CID 70749819
1-(2-amino-2-oxoethyl)-N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]piperidine-3-carboxamide
CID 70759029
1-acetyl-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-3-piperidinecarboxamide
CID 72845553
N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-1-(methoxyacetyl)-3-piperidinecarboxamide
CID 72880511
N~3~-[2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-N~1~,N~1~-dimethyl-1,3-piperidinedicarboxamide
CID 72920322

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide (CID 30476207) is N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide.
What is the SMILES notation for N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The canonical SMILES for N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide is Cc1nn(C)c(C)c1CC(=O)NCC(C)(C)N1CCOCC1.
What is the InChIKey of N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The InChIKey is YRLZVKJRPVFEQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O2/c1-12-14(13(2)19(5)18-12)10-15(21)17-11-16(3,4)20-6-8-22-9-7-20/h6-11H2,1-5H3,(H,17,21).
What are the key properties of N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide?
N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide has a molecular weight of 308.43 g/mol, XLogP of 0.81, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-morpholin-4-ylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide is sourced from PubChem (CID 30476207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).