N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide

C14H20N4O2 — CID 5308038

IUPACN-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide
SMILESCc1cc(-c2ccco2)n(CC(=O)NCCN(C)C)n1
InChIInChI=1S/C14H20N4O2/c1-11-9-12(13-5-4-8-20-13)18(16-11)10-14(19)15-6-7-17(2)3/h4-5,8-9H,6-7,10H2,1-3H3,(H,15,19)
InChIKeyDDQGTSSSQUPFGV-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.13
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide

N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide (PubChem CID 5308038) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide
PubChem CID5308038
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide
SMILESCc1cc(-c2ccco2)n(CC(=O)NCCN(C)C)n1
InChIInChI=1S/C14H20N4O2/c1-11-9-12(13-5-4-8-20-13)18(16-11)10-14(19)15-6-7-17(2)3/h4-5,8-9H,6-7,10H2,1-3H3,(H,15,19)
InChIKeyDDQGTSSSQUPFGV-UHFFFAOYSA-N
XLogP1.13
TPSA63.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide (CID 5308038) is N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide is Cc1cc(-c2ccco2)n(CC(=O)NCCN(C)C)n1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide?
The InChIKey is DDQGTSSSQUPFGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-11-9-12(13-5-4-8-20-13)18(16-11)10-14(19)15-6-7-17(2)3/h4-5,8-9H,6-7,10H2,1-3H3,(H,15,19).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide?
N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide has a molecular weight of 276.34 g/mol, XLogP of 1.13, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide is sourced from PubChem (CID 5308038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).