N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide

C11H19N3O3 — CID 43579084

IUPACN-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide
SMILESCN(CC(=O)NC1CC1)C(=O)C1CC(O)CN1
InChIInChI=1S/C11H19N3O3/c1-14(6-10(16)13-7-2-3-7)11(17)9-4-8(15)5-12-9/h7-9,12,15H,2-6H2,1H3,(H,13,16)
InChIKeyPRBBDZRAFQDIGH-UHFFFAOYSA-N
MW241.29 g/mol
LogP-1.55
Rot. Bonds4

About N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide

N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide (PubChem CID 43579084) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide
PubChem CID43579084
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC NameN-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide
SMILESCN(CC(=O)NC1CC1)C(=O)C1CC(O)CN1
InChIInChI=1S/C11H19N3O3/c1-14(6-10(16)13-7-2-3-7)11(17)9-4-8(15)5-12-9/h7-9,12,15H,2-6H2,1H3,(H,13,16)
InChIKeyPRBBDZRAFQDIGH-UHFFFAOYSA-N
XLogP-1.55
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-1.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide?
The IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide (CID 43579084) is N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide?
The canonical SMILES for N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide is CN(CC(=O)NC1CC1)C(=O)C1CC(O)CN1.
What is the InChIKey of N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide?
The InChIKey is PRBBDZRAFQDIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-14(6-10(16)13-7-2-3-7)11(17)9-4-8(15)5-12-9/h7-9,12,15H,2-6H2,1H3,(H,13,16).
What are the key properties of N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide?
N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide has a molecular weight of 241.29 g/mol, XLogP of -1.55, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylamino)-2-oxoethyl]-4-hydroxy-N-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 43579084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).