7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine

C16H20N2 — CID 156547598

IUPAC7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine
SMILESC=C(CC)c1cc2c(cc1N)CC1(CC1)C(=C)N2
InChIInChI=1S/C16H20N2/c1-4-10(2)13-8-15-12(7-14(13)17)9-16(5-6-16)11(3)18-15/h7-8,18H,2-6,9,17H2,1H3
InChIKeyFUZUJGJGWLZEJY-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.95
Rot. Bonds2

About 7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine

7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine (PubChem CID 156547598) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine.

Molecular Properties

Compound Name7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine
PubChem CID156547598
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine
SMILESC=C(CC)c1cc2c(cc1N)CC1(CC1)C(=C)N2
InChIInChI=1S/C16H20N2/c1-4-10(2)13-8-15-12(7-14(13)17)9-16(5-6-16)11(3)18-15/h7-8,18H,2-6,9,17H2,1H3
InChIKeyFUZUJGJGWLZEJY-UHFFFAOYSA-N
XLogP3.95
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine?
The IUPAC name of 7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine (CID 156547598) is 7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine.
What is the SMILES notation for 7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine?
The canonical SMILES for 7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine is C=C(CC)c1cc2c(cc1N)CC1(CC1)C(=C)N2.
What is the InChIKey of 7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine?
The InChIKey is FUZUJGJGWLZEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-4-10(2)13-8-15-12(7-14(13)17)9-16(5-6-16)11(3)18-15/h7-8,18H,2-6,9,17H2,1H3.
What are the key properties of 7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine?
7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine has a molecular weight of 240.35 g/mol, XLogP of 3.95, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-but-1-en-2-yl-2-methylidenespiro[1,4-dihydroquinoline-3,1'-cyclopropane]-6-amine is sourced from PubChem (CID 156547598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).