3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide

C10H19N3O2 — CID 102779940

IUPAC3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide
SMILESCC1CCNC1C(=O)NN1CCOCC1
InChIInChI=1S/C10H19N3O2/c1-8-2-3-11-9(8)10(14)12-13-4-6-15-7-5-13/h8-9,11H,2-7H2,1H3,(H,12,14)
InChIKeyRNTWIJAKUYESIT-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.65
Rot. Bonds2

About 3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide

3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide (PubChem CID 102779940) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide
PubChem CID102779940
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide
SMILESCC1CCNC1C(=O)NN1CCOCC1
InChIInChI=1S/C10H19N3O2/c1-8-2-3-11-9(8)10(14)12-13-4-6-15-7-5-13/h8-9,11H,2-7H2,1H3,(H,12,14)
InChIKeyRNTWIJAKUYESIT-UHFFFAOYSA-N
XLogP-0.65
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide?
The IUPAC name of 3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide (CID 102779940) is 3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide?
The canonical SMILES for 3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide is CC1CCNC1C(=O)NN1CCOCC1.
What is the InChIKey of 3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide?
The InChIKey is RNTWIJAKUYESIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-8-2-3-11-9(8)10(14)12-13-4-6-15-7-5-13/h8-9,11H,2-7H2,1H3,(H,12,14).
What are the key properties of 3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide?
3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide has a molecular weight of 213.28 g/mol, XLogP of -0.65, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 102779940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).