N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine

C14H18N4 — CID 63300015

IUPACN-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine
SMILESCCN(c1cnc2ccccc2n1)C1CCNC1
InChIInChI=1S/C14H18N4/c1-2-18(11-7-8-15-9-11)14-10-16-12-5-3-4-6-13(12)17-14/h3-6,10-11,15H,2,7-9H2,1H3
InChIKeyZRFWVJJFBOHCJV-UHFFFAOYSA-N
MW242.33 g/mol
LogP1.82
Rot. Bonds3

About N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine

N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine (PubChem CID 63300015) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine.

Molecular Properties

Compound NameN-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine
PubChem CID63300015
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC NameN-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine
SMILESCCN(c1cnc2ccccc2n1)C1CCNC1
InChIInChI=1S/C14H18N4/c1-2-18(11-7-8-15-9-11)14-10-16-12-5-3-4-6-13(12)17-14/h3-6,10-11,15H,2,7-9H2,1H3
InChIKeyZRFWVJJFBOHCJV-UHFFFAOYSA-N
XLogP1.82
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine?
The IUPAC name of N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine (CID 63300015) is N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine.
What is the SMILES notation for N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine?
The canonical SMILES for N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine is CCN(c1cnc2ccccc2n1)C1CCNC1.
What is the InChIKey of N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine?
The InChIKey is ZRFWVJJFBOHCJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-2-18(11-7-8-15-9-11)14-10-16-12-5-3-4-6-13(12)17-14/h3-6,10-11,15H,2,7-9H2,1H3.
What are the key properties of N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine?
N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine has a molecular weight of 242.33 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-pyrrolidin-3-ylquinoxalin-2-amine is sourced from PubChem (CID 63300015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).