2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine

C15H19N3 — CID 113230822

IUPAC2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine
SMILESCC(CNCc1cnc2ccccc2n1)C1CC1
InChIInChI=1S/C15H19N3/c1-11(12-6-7-12)8-16-9-13-10-17-14-4-2-3-5-15(14)18-13/h2-5,10-12,16H,6-9H2,1H3
InChIKeyAMPOOLWBHDRGFT-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.77
Rot. Bonds5

About 2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine

2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine (PubChem CID 113230822) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine
PubChem CID113230822
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine
SMILESCC(CNCc1cnc2ccccc2n1)C1CC1
InChIInChI=1S/C15H19N3/c1-11(12-6-7-12)8-16-9-13-10-17-14-4-2-3-5-15(14)18-13/h2-5,10-12,16H,6-9H2,1H3
InChIKeyAMPOOLWBHDRGFT-UHFFFAOYSA-N
XLogP2.77
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine?
The IUPAC name of 2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine (CID 113230822) is 2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine?
The canonical SMILES for 2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine is CC(CNCc1cnc2ccccc2n1)C1CC1.
What is the InChIKey of 2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine?
The InChIKey is AMPOOLWBHDRGFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11(12-6-7-12)8-16-9-13-10-17-14-4-2-3-5-15(14)18-13/h2-5,10-12,16H,6-9H2,1H3.
What are the key properties of 2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine?
2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine has a molecular weight of 241.34 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine is sourced from PubChem (CID 113230822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).