N-[2-(1-aminoethyl)phenyl]quinolin-2-amine

C17H17N3 — CID 63759098

IUPACN-[2-(1-aminoethyl)phenyl]quinolin-2-amine
SMILESCC(N)c1ccccc1Nc1ccc2ccccc2n1
InChIInChI=1S/C17H17N3/c1-12(18)14-7-3-5-9-16(14)20-17-11-10-13-6-2-4-8-15(13)19-17/h2-12H,18H2,1H3,(H,19,20)
InChIKeyRAAGIOXBCACLMP-UHFFFAOYSA-N
MW263.34 g/mol
LogP4.00
Rot. Bonds3

About N-[2-(1-aminoethyl)phenyl]quinolin-2-amine

N-[2-(1-aminoethyl)phenyl]quinolin-2-amine (PubChem CID 63759098) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-[2-(1-aminoethyl)phenyl]quinolin-2-amine.

Molecular Properties

Compound NameN-[2-(1-aminoethyl)phenyl]quinolin-2-amine
PubChem CID63759098
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC NameN-[2-(1-aminoethyl)phenyl]quinolin-2-amine
SMILESCC(N)c1ccccc1Nc1ccc2ccccc2n1
InChIInChI=1S/C17H17N3/c1-12(18)14-7-3-5-9-16(14)20-17-11-10-13-6-2-4-8-15(13)19-17/h2-12H,18H2,1H3,(H,19,20)
InChIKeyRAAGIOXBCACLMP-UHFFFAOYSA-N
XLogP4.00
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1-aminoethyl)phenyl]quinolin-2-amine?
The IUPAC name of N-[2-(1-aminoethyl)phenyl]quinolin-2-amine (CID 63759098) is N-[2-(1-aminoethyl)phenyl]quinolin-2-amine.
What is the SMILES notation for N-[2-(1-aminoethyl)phenyl]quinolin-2-amine?
The canonical SMILES for N-[2-(1-aminoethyl)phenyl]quinolin-2-amine is CC(N)c1ccccc1Nc1ccc2ccccc2n1.
What is the InChIKey of N-[2-(1-aminoethyl)phenyl]quinolin-2-amine?
The InChIKey is RAAGIOXBCACLMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-12(18)14-7-3-5-9-16(14)20-17-11-10-13-6-2-4-8-15(13)19-17/h2-12H,18H2,1H3,(H,19,20).
What are the key properties of N-[2-(1-aminoethyl)phenyl]quinolin-2-amine?
N-[2-(1-aminoethyl)phenyl]quinolin-2-amine has a molecular weight of 263.34 g/mol, XLogP of 4.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-aminoethyl)phenyl]quinolin-2-amine is sourced from PubChem (CID 63759098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).