5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine

C18H17N3 — CID 107844436

IUPAC5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine
SMILESNc1ccc(NC2Cc3ccccc3C2)c2cccnc12
InChIInChI=1S/C18H17N3/c19-16-7-8-17(15-6-3-9-20-18(15)16)21-14-10-12-4-1-2-5-13(12)11-14/h1-9,14,21H,10-11,19H2
InChIKeyLHLNPDLLILMSEV-UHFFFAOYSA-N
MW275.36 g/mol
LogP3.40
Rot. Bonds2

About 5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine

5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine (PubChem CID 107844436) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is 5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine.

Molecular Properties

Compound Name5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine
PubChem CID107844436
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC Name5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine
SMILESNc1ccc(NC2Cc3ccccc3C2)c2cccnc12
InChIInChI=1S/C18H17N3/c19-16-7-8-17(15-6-3-9-20-18(15)16)21-14-10-12-4-1-2-5-13(12)11-14/h1-9,14,21H,10-11,19H2
InChIKeyLHLNPDLLILMSEV-UHFFFAOYSA-N
XLogP3.40
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-[(8-aminoquinolin-5-yl)amino]piperidin-2-one
CID 63660995
N-(2,3-dihydro-1H-inden-2-yl)quinolin-8-amine
CID 43512766
4-N-cyclopropylquinoline-4,8-diamine
CID 83059537
4-[(8-aminoquinolin-4-yl)amino]pyrrolidin-2-one
CID 106182802
5-N-(2-iodophenyl)quinoline-5,8-diamine
CID 43449502
N-(8-aminoquinolin-5-yl)cyclopropanecarboxamide
CID 104826399
N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinolin-5-amine
CID 43759315
5-N-(cyclohexylmethyl)quinoline-5,8-diamine
CID 43449567
N-(2,3-dihydro-1H-inden-2-yl)naphthalen-1-amine
CID 43512758
5-(1,3-dihydroisoindol-2-yl)quinolin-8-amine
CID 62204659
3-N-(2,3-dihydro-1H-inden-2-yl)-2-N,2-N-dimethylpyridine-2,3-diamine
CID 43708000
5-N-(2,6-dimethylpiperidin-1-yl)quinoline-5,8-diamine
CID 83004330

Frequently Asked Questions

What is the IUPAC name of 5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine?
The IUPAC name of 5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine (CID 107844436) is 5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine.
What is the SMILES notation for 5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine?
The canonical SMILES for 5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine is Nc1ccc(NC2Cc3ccccc3C2)c2cccnc12.
What is the InChIKey of 5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine?
The InChIKey is LHLNPDLLILMSEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c19-16-7-8-17(15-6-3-9-20-18(15)16)21-14-10-12-4-1-2-5-13(12)11-14/h1-9,14,21H,10-11,19H2.
What are the key properties of 5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine?
5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine has a molecular weight of 275.36 g/mol, XLogP of 3.40, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine is sourced from PubChem (CID 107844436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).