4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide

C13H24N2O2 — CID 119821380

IUPAC4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide
SMILESCC(C)CC1(CNC(=O)C2CC(O)CN2)CC1
InChIInChI=1S/C13H24N2O2/c1-9(2)6-13(3-4-13)8-15-12(17)11-5-10(16)7-14-11/h9-11,14,16H,3-8H2,1-2H3,(H,15,17)
InChIKeyGWCSEVACZCGHPM-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.65
Rot. Bonds5

About 4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide

4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide (PubChem CID 119821380) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide
PubChem CID119821380
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide
SMILESCC(C)CC1(CNC(=O)C2CC(O)CN2)CC1
InChIInChI=1S/C13H24N2O2/c1-9(2)6-13(3-4-13)8-15-12(17)11-5-10(16)7-14-11/h9-11,14,16H,3-8H2,1-2H3,(H,15,17)
InChIKeyGWCSEVACZCGHPM-UHFFFAOYSA-N
XLogP0.65
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide?
The IUPAC name of 4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide (CID 119821380) is 4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide is CC(C)CC1(CNC(=O)C2CC(O)CN2)CC1.
What is the InChIKey of 4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide?
The InChIKey is GWCSEVACZCGHPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-9(2)6-13(3-4-13)8-15-12(17)11-5-10(16)7-14-11/h9-11,14,16H,3-8H2,1-2H3,(H,15,17).
What are the key properties of 4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide?
4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.65, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 119821380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).