7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine

C24H34N2O — CID 159487559

IUPAC7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine
SMILESCCCc1cc2c(N)nc3cc(CCCCCCC(C)(C)C)ccc3c2o1
InChIInChI=1S/C24H34N2O/c1-5-10-18-16-20-22(27-18)19-13-12-17(15-21(19)26-23(20)25)11-8-6-7-9-14-24(2,3)4/h12-13,15-16H,5-11,14H2,1-4H3,(H2,25,26)
InChIKeyLXTQFDYXUDFDDV-UHFFFAOYSA-N
MW366.55 g/mol
LogP7.05
Rot. Bonds8

About 7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine

7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine (PubChem CID 159487559) has the molecular formula C24H34N2O and a molecular weight of 366.55 g/mol. Its IUPAC name is 7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine.

Molecular Properties

Compound Name7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine
PubChem CID159487559
Molecular FormulaC24H34N2O
Molecular Weight366.55 g/mol
Exact Mass366.27
IUPAC Name7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine
SMILESCCCc1cc2c(N)nc3cc(CCCCCCC(C)(C)C)ccc3c2o1
InChIInChI=1S/C24H34N2O/c1-5-10-18-16-20-22(27-18)19-13-12-17(15-21(19)26-23(20)25)11-8-6-7-9-14-24(2,3)4/h12-13,15-16H,5-11,14H2,1-4H3,(H2,25,26)
InChIKeyLXTQFDYXUDFDDV-UHFFFAOYSA-N
XLogP7.05
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.55
LogP ≤ 57.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

7-(7,7-dimethyloctyl)-2-(ethylaminomethyl)-1H-pyrrolo[3,2-c]quinolin-4-amine
CID 158027544
7-(5,5-dimethylhexyl)-2-methanidyl-3H-imidazo[4,5-c]quinolin-4-amine;8-(5,5-dimethylhexyl)-2-methanidyl-3H-imidazo[4,5-c]quinolin-4-amine;ethane;bis(vanadium(2+))
CID 158341760
1,4-bis(10,10-dimethylundecyl)benzene
CID 151982772
5-decyl-2-propyl-1,3-benzoxazole
CID 170290487
5-butyl-2-propyl-1,3-benzoxazol-7-amine
CID 94977224
2-(2,2-dimethylpropyl)-5-propyl-1,3-benzoxazol-7-amine
CID 82232206
4-(10,10-dimethylundecyl)-1,2-dimethylbenzene
CID 150895968
3-[5-(4-amino-2-butyl-2,3-dihydro-1H-imidazo[4,5-c]quinolin-7-yl)pentyl-methylamino]-2,2-dimethylpropane-1-thiol
CID 155696729
5-propyl-1,3-benzoxazol-2-amine
CID 62548389
27,27-dimethyloctacosylbenzene
CID 140589361
6,18-dipropyl-3,15-dioxahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4(9),5,7,11,14(22),16(21),17,19,23-undecaene
CID 70938401
4-decyl-6-octylnaphthalen-1-amine
CID 139692308

Frequently Asked Questions

What is the IUPAC name of 7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine?
The IUPAC name of 7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine (CID 159487559) is 7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine.
What is the SMILES notation for 7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine?
The canonical SMILES for 7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine is CCCc1cc2c(N)nc3cc(CCCCCCC(C)(C)C)ccc3c2o1.
What is the InChIKey of 7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine?
The InChIKey is LXTQFDYXUDFDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34N2O/c1-5-10-18-16-20-22(27-18)19-13-12-17(15-21(19)26-23(20)25)11-8-6-7-9-14-24(2,3)4/h12-13,15-16H,5-11,14H2,1-4H3,(H2,25,26).
What are the key properties of 7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine?
7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine has a molecular weight of 366.55 g/mol, XLogP of 7.05, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(7,7-dimethyloctyl)-2-propylfuro[3,2-c]quinolin-4-amine is sourced from PubChem (CID 159487559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).