3-(aminomethyl)-4-phenylquinolin-2-amine

C16H15N3 — CID 10285988

IUPAC3-(aminomethyl)-4-phenylquinolin-2-amine
SMILESNCc1c(N)nc2ccccc2c1-c1ccccc1
InChIInChI=1S/C16H15N3/c17-10-13-15(11-6-2-1-3-7-11)12-8-4-5-9-14(12)19-16(13)18/h1-9H,10,17H2,(H2,18,19)
InChIKeyUPLLVKSWAGMESP-UHFFFAOYSA-N
MW249.32 g/mol
LogP2.94
Rot. Bonds2

About 3-(aminomethyl)-4-phenylquinolin-2-amine

3-(aminomethyl)-4-phenylquinolin-2-amine (PubChem CID 10285988) has the molecular formula C16H15N3 and a molecular weight of 249.32 g/mol. Its IUPAC name is 3-(aminomethyl)-4-phenylquinolin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-4-phenylquinolin-2-amine
PubChem CID10285988
Molecular FormulaC16H15N3
Molecular Weight249.32 g/mol
Exact Mass249.13
IUPAC Name3-(aminomethyl)-4-phenylquinolin-2-amine
SMILESNCc1c(N)nc2ccccc2c1-c1ccccc1
InChIInChI=1S/C16H15N3/c17-10-13-15(11-6-2-1-3-7-11)12-8-4-5-9-14(12)19-16(13)18/h1-9H,10,17H2,(H2,18,19)
InChIKeyUPLLVKSWAGMESP-UHFFFAOYSA-N
XLogP2.94
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-4-phenylquinolin-2-amine?
The IUPAC name of 3-(aminomethyl)-4-phenylquinolin-2-amine (CID 10285988) is 3-(aminomethyl)-4-phenylquinolin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-4-phenylquinolin-2-amine?
The canonical SMILES for 3-(aminomethyl)-4-phenylquinolin-2-amine is NCc1c(N)nc2ccccc2c1-c1ccccc1.
What is the InChIKey of 3-(aminomethyl)-4-phenylquinolin-2-amine?
The InChIKey is UPLLVKSWAGMESP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3/c17-10-13-15(11-6-2-1-3-7-11)12-8-4-5-9-14(12)19-16(13)18/h1-9H,10,17H2,(H2,18,19).
What are the key properties of 3-(aminomethyl)-4-phenylquinolin-2-amine?
3-(aminomethyl)-4-phenylquinolin-2-amine has a molecular weight of 249.32 g/mol, XLogP of 2.94, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-4-phenylquinolin-2-amine is sourced from PubChem (CID 10285988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).