6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine

C19H19N3 — CID 68628477

IUPAC6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine
SMILESNCc1ccc2nc(N[C@@H]3CCc4ccccc43)ccc2c1
InChIInChI=1S/C19H19N3/c20-12-13-5-8-17-15(11-13)7-10-19(21-17)22-18-9-6-14-3-1-2-4-16(14)18/h1-5,7-8,10-11,18H,6,9,12,20H2,(H,21,22)/t18-/m1/s1
InChIKeyGCQCHNYZFDRGAY-GOSISDBHSA-N
MW289.38 g/mol
LogP3.79
Rot. Bonds3

About 6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine

6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine (PubChem CID 68628477) has the molecular formula C19H19N3 and a molecular weight of 289.38 g/mol. Its IUPAC name is 6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine
PubChem CID68628477
Molecular FormulaC19H19N3
Molecular Weight289.38 g/mol
Exact Mass289.16
IUPAC Name6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine
SMILESNCc1ccc2nc(N[C@@H]3CCc4ccccc43)ccc2c1
InChIInChI=1S/C19H19N3/c20-12-13-5-8-17-15(11-13)7-10-19(21-17)22-18-9-6-14-3-1-2-4-16(14)18/h1-5,7-8,10-11,18H,6,9,12,20H2,(H,21,22)/t18-/m1/s1
InChIKeyGCQCHNYZFDRGAY-GOSISDBHSA-N
XLogP3.79
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine?
The IUPAC name of 6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine (CID 68628477) is 6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine.
What is the SMILES notation for 6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine?
The canonical SMILES for 6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine is NCc1ccc2nc(N[C@@H]3CCc4ccccc43)ccc2c1.
What is the InChIKey of 6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine?
The InChIKey is GCQCHNYZFDRGAY-GOSISDBHSA-N. The full InChI is InChI=1S/C19H19N3/c20-12-13-5-8-17-15(11-13)7-10-19(21-17)22-18-9-6-14-3-1-2-4-16(14)18/h1-5,7-8,10-11,18H,6,9,12,20H2,(H,21,22)/t18-/m1/s1.
What are the key properties of 6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine?
6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine has a molecular weight of 289.38 g/mol, XLogP of 3.79, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine is sourced from PubChem (CID 68628477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).