N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide

C13H22N4O2 — CID 50952291

IUPACN-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide
SMILESCOCCN(Cc1cnn(C)c1)C(=O)C1CCNC1
InChIInChI=1S/C13H22N4O2/c1-16-9-11(7-15-16)10-17(5-6-19-2)13(18)12-3-4-14-8-12/h7,9,12,14H,3-6,8,10H2,1-2H3
InChIKeyZNOXJURERGWXFY-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.00
Rot. Bonds6

About N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide

N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide (PubChem CID 50952291) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide
PubChem CID50952291
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC NameN-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide
SMILESCOCCN(Cc1cnn(C)c1)C(=O)C1CCNC1
InChIInChI=1S/C13H22N4O2/c1-16-9-11(7-15-16)10-17(5-6-19-2)13(18)12-3-4-14-8-12/h7,9,12,14H,3-6,8,10H2,1-2H3
InChIKeyZNOXJURERGWXFY-UHFFFAOYSA-N
XLogP0.00
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide (CID 50952291) is N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide is COCCN(Cc1cnn(C)c1)C(=O)C1CCNC1.
What is the InChIKey of N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide?
The InChIKey is ZNOXJURERGWXFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-16-9-11(7-15-16)10-17(5-6-19-2)13(18)12-3-4-14-8-12/h7,9,12,14H,3-6,8,10H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide?
N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 0.00, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 50952291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).