N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide

C11H21N3O2 — CID 60962738

IUPACN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide
SMILESCC(C)CN(CC(N)=O)C(=O)C1CCCN1
InChIInChI=1S/C11H21N3O2/c1-8(2)6-14(7-10(12)15)11(16)9-4-3-5-13-9/h8-9,13H,3-7H2,1-2H3,(H2,12,15)
InChIKeyCQWXIRXWCUZLHW-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.29
Rot. Bonds5

About N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide

N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide (PubChem CID 60962738) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide
PubChem CID60962738
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC NameN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide
SMILESCC(C)CN(CC(N)=O)C(=O)C1CCCN1
InChIInChI=1S/C11H21N3O2/c1-8(2)6-14(7-10(12)15)11(16)9-4-3-5-13-9/h8-9,13H,3-7H2,1-2H3,(H2,12,15)
InChIKeyCQWXIRXWCUZLHW-UHFFFAOYSA-N
XLogP-0.29
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-methylpropyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
CID 103869277
(2R)-N-ethyl-N-(2-methylpropyl)pyrrolidine-2-carboxamide
CID 93267754
(2R)-N,N-bis(2-amino-2-oxoethyl)piperidine-2-carboxamide
CID 104913884
methyl 3-[2-methylpropyl-[(2R)-pyrrolidine-2-carbonyl]amino]propanoate
CID 93373232
(2S)-N-ethyl-N-(2-methylpropyl)piperidine-2-carboxamide
CID 93273990
N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 54871879
N-(2-amino-2-oxoethyl)-4-hydroxy-N-(2-methylpropyl)pyrrolidine-2-carboxamide
CID 60963717
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-2-piperidin-2-ylacetamide
CID 55003946
(2R)-N-ethyl-N-(2-methylbutyl)pyrrolidine-2-carboxamide
CID 103797895
(2S)-N-(2-cyanoethyl)-N-(2-methylpropyl)piperidine-2-carboxamide
CID 93375201
(2R)-N,N-diethylpyrrolidine-2-carboxamide
CID 952316
(2R)-N-(2-amino-2-oxoethyl)-N-cyclopentylpyrrolidine-2-carboxamide
CID 93372174

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide (CID 60962738) is N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide is CC(C)CN(CC(N)=O)C(=O)C1CCCN1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide?
The InChIKey is CQWXIRXWCUZLHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-8(2)6-14(7-10(12)15)11(16)9-4-3-5-13-9/h8-9,13H,3-7H2,1-2H3,(H2,12,15).
What are the key properties of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide?
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide has a molecular weight of 227.31 g/mol, XLogP of -0.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 60962738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).