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

C7H13N3O2 — CID 18324145

IUPACN-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide
SMILESNC(=O)CNC(=O)C1CCCN1
InChIInChI=1S/C7H13N3O2/c8-6(11)4-10-7(12)5-2-1-3-9-5/h5,9H,1-4H2,(H2,8,11)(H,10,12)
InChIKeyMZKZJHTZJCEFKZ-UHFFFAOYSA-N
MW171.20 g/mol
LogP-1.66
Rot. Bonds3

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

N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide (PubChem CID 18324145) has the molecular formula C7H13N3O2 and a molecular weight of 171.20 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide
PubChem CID18324145
Molecular FormulaC7H13N3O2
Molecular Weight171.20 g/mol
Exact Mass171.10
IUPAC NameN-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide
SMILESNC(=O)CNC(=O)C1CCCN1
InChIInChI=1S/C7H13N3O2/c8-6(11)4-10-7(12)5-2-1-3-9-5/h5,9H,1-4H2,(H2,8,11)(H,10,12)
InChIKeyMZKZJHTZJCEFKZ-UHFFFAOYSA-N
XLogP-1.66
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 5-1.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(2-amino-2-oxoethyl)azetidine-2-carboxamide;hydrochloride
CID 130742026
(2S)-N-[2-(hydroxyamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 10419946
N-(2-methylprop-2-enyl)pyrrolidine-2-carboxamide
CID 112703892
(2R)-N-[2-[(2-aminoacetyl)amino]-2-oxoethyl]pyrrolidine-2-carboxamide
CID 66887574
N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 43419759
(2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide
CID 141027681
N-(fluoromethyl)pyrrolidine-2-carboxamide
CID 123273673
N-(2-amino-2-oxoethyl)-3-methylpiperidine-2-carboxamide
CID 62338928
N-[2-(cyclopentylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 83620464
N-(3-amino-2-hydroxy-3-oxopropyl)pyrrolidine-2-carboxamide
CID 106175824
(2S)-N-[2-oxo-2-[8-[[2-[[(2S)-pyrrolidine-2-carbonyl]amino]acetyl]amino]octylamino]ethyl]pyrrolidine-2-carboxamide
CID 102333341
(2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)(15N)amino]-4-methyl-1-oxo(113C)pentan-2-yl]pyrrolidine-2-carboxamide
CID 10266003

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide (CID 18324145) is N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide is NC(=O)CNC(=O)C1CCCN1.
What is the InChIKey of N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide?
The InChIKey is MZKZJHTZJCEFKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2/c8-6(11)4-10-7(12)5-2-1-3-9-5/h5,9H,1-4H2,(H2,8,11)(H,10,12).
What are the key properties of N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide?
N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide has a molecular weight of 171.20 g/mol, XLogP of -1.66, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 18324145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).