N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide

C10H17N3O2 — CID 43419759

IUPACN-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
SMILESO=C(CNC(=O)C1CCCN1)NC1CC1
InChIInChI=1S/C10H17N3O2/c14-9(13-7-3-4-7)6-12-10(15)8-2-1-5-11-8/h7-8,11H,1-6H2,(H,12,15)(H,13,14)
InChIKeyNJKPFBCUVDRTBR-UHFFFAOYSA-N
MW211.26 g/mol
LogP-0.87
Rot. Bonds4

About N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide

N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide (PubChem CID 43419759) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
PubChem CID43419759
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC NameN-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
SMILESO=C(CNC(=O)C1CCCN1)NC1CC1
InChIInChI=1S/C10H17N3O2/c14-9(13-7-3-4-7)6-12-10(15)8-2-1-5-11-8/h7-8,11H,1-6H2,(H,12,15)(H,13,14)
InChIKeyNJKPFBCUVDRTBR-UHFFFAOYSA-N
XLogP-0.87
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 5-0.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide?
The IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide (CID 43419759) is N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide is O=C(CNC(=O)C1CCCN1)NC1CC1.
What is the InChIKey of N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide?
The InChIKey is NJKPFBCUVDRTBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c14-9(13-7-3-4-7)6-12-10(15)8-2-1-5-11-8/h7-8,11H,1-6H2,(H,12,15)(H,13,14).
What are the key properties of N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide?
N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide has a molecular weight of 211.26 g/mol, XLogP of -0.87, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 43419759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).