N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide

C14H24N4O2 — CID 56912382

IUPACN-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide
SMILESCN(CCCc1cnn(C)c1)C(=O)CC1COCCN1
InChIInChI=1S/C14H24N4O2/c1-17(6-3-4-12-9-16-18(2)10-12)14(19)8-13-11-20-7-5-15-13/h9-10,13,15H,3-8,11H2,1-2H3
InChIKeyOROBLZHMMSOXPC-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.19
Rot. Bonds6

About N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide

N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide (PubChem CID 56912382) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide.

Molecular Properties

Compound NameN-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide
PubChem CID56912382
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC NameN-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide
SMILESCN(CCCc1cnn(C)c1)C(=O)CC1COCCN1
InChIInChI=1S/C14H24N4O2/c1-17(6-3-4-12-9-16-18(2)10-12)14(19)8-13-11-20-7-5-15-13/h9-10,13,15H,3-8,11H2,1-2H3
InChIKeyOROBLZHMMSOXPC-UHFFFAOYSA-N
XLogP0.19
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide?
The IUPAC name of N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide (CID 56912382) is N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide.
What is the SMILES notation for N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide?
The canonical SMILES for N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide is CN(CCCc1cnn(C)c1)C(=O)CC1COCCN1.
What is the InChIKey of N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide?
The InChIKey is OROBLZHMMSOXPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-17(6-3-4-12-9-16-18(2)10-12)14(19)8-13-11-20-7-5-15-13/h9-10,13,15H,3-8,11H2,1-2H3.
What are the key properties of N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide?
N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide has a molecular weight of 280.37 g/mol, XLogP of 0.19, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-2-morpholin-3-ylacetamide is sourced from PubChem (CID 56912382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).