N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine

C19H18N2 — CID 104694189

IUPACN-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine
SMILESc1ccc2c(c1)CC(NCc1ccc3ncccc3c1)C2
InChIInChI=1S/C19H18N2/c1-2-5-16-12-18(11-15(16)4-1)21-13-14-7-8-19-17(10-14)6-3-9-20-19/h1-10,18,21H,11-13H2
InChIKeyFDCZVJYSMMWJNB-UHFFFAOYSA-N
MW274.37 g/mol
LogP3.49
Rot. Bonds3

About N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine

N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine (PubChem CID 104694189) has the molecular formula C19H18N2 and a molecular weight of 274.37 g/mol. Its IUPAC name is N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine
PubChem CID104694189
Molecular FormulaC19H18N2
Molecular Weight274.37 g/mol
Exact Mass274.15
IUPAC NameN-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine
SMILESc1ccc2c(c1)CC(NCc1ccc3ncccc3c1)C2
InChIInChI=1S/C19H18N2/c1-2-5-16-12-18(11-15(16)4-1)21-13-14-7-8-19-17(10-14)6-3-9-20-19/h1-10,18,21H,11-13H2
InChIKeyFDCZVJYSMMWJNB-UHFFFAOYSA-N
XLogP3.49
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(quinolin-6-ylmethyl)thian-4-amine
CID 115615624
2,2-dimethyl-N-(quinolin-6-ylmethyl)cyclopropan-1-amine
CID 61222294
4-(quinolin-6-ylmethylamino)cyclohexane-1-carboxamide
CID 61042772
N-(quinolin-7-ylmethyl)cyclopropanamine
CID 78921001
1-propyl-N-(quinolin-6-ylmethyl)piperidin-4-amine
CID 60664069
2-methyl-N-(quinolin-6-ylmethyl)cyclohexan-1-amine
CID 43183350
tert-butyl 3-(quinolin-6-ylmethylamino)azetidine-1-carboxylate
CID 103748619
1-methyl-N-(quinolin-6-ylmethyl)cyclopropan-1-amine
CID 115635138
(1S)-1-cycloheptyl-N-(quinolin-6-ylmethyl)ethanamine
CID 81388844
2-(hydroxymethyl)-2-(quinolin-6-ylmethylamino)propane-1,3-diol
CID 107850850
3-cyclopropyl-N-(quinolin-6-ylmethyl)propan-1-amine
CID 115639548
(3R,7S,8aS)-3-(benzylsulfanylmethyl)-7-(quinolin-6-ylmethylamino)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
CID 126460276

Frequently Asked Questions

What is the IUPAC name of N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine (CID 104694189) is N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine is c1ccc2c(c1)CC(NCc1ccc3ncccc3c1)C2.
What is the InChIKey of N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine?
The InChIKey is FDCZVJYSMMWJNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2/c1-2-5-16-12-18(11-15(16)4-1)21-13-14-7-8-19-17(10-14)6-3-9-20-19/h1-10,18,21H,11-13H2.
What are the key properties of N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine?
N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine has a molecular weight of 274.37 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(quinolin-6-ylmethyl)-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 104694189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).