N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine

C17H18N2O — CID 81231383

IUPACN-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccc2cccnc2c1)c1ccco1
InChIInChI=1S/C17H18N2O/c1-2-9-19-17(16-6-4-11-20-16)14-8-7-13-5-3-10-18-15(13)12-14/h3-8,10-12,17,19H,2,9H2,1H3
InChIKeyNVAWUUVELVLHCP-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.92
Rot. Bonds5

About N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine

N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine (PubChem CID 81231383) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine
PubChem CID81231383
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC NameN-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccc2cccnc2c1)c1ccco1
InChIInChI=1S/C17H18N2O/c1-2-9-19-17(16-6-4-11-20-16)14-8-7-13-5-3-10-18-15(13)12-14/h3-8,10-12,17,19H,2,9H2,1H3
InChIKeyNVAWUUVELVLHCP-UHFFFAOYSA-N
XLogP3.92
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-propyl-1-quinolin-7-ylpropan-1-amine
CID 81220696
N-[(3,4-difluorophenyl)-(furan-2-yl)methyl]propan-1-amine
CID 43496452
N-[(5-chlorothiophen-2-yl)-quinolin-7-ylmethyl]propan-1-amine
CID 105021397
N-[(4-methylthiadiazol-5-yl)-quinolin-7-ylmethyl]propan-1-amine
CID 105172648
furan-2-yl(quinolin-7-yl)methanol
CID 81216478
2-cyclopropyl-N-propyl-1-quinolin-7-ylpropan-1-amine
CID 105021677
N-[(2-chlorofuran-3-yl)-quinolin-7-ylmethyl]ethanamine
CID 106692808
N-(2-ethylsulfanyl-1-quinolin-7-ylethyl)propan-1-amine
CID 81231399
N-[(4-bromo-3-chlorophenyl)-(furan-2-yl)methyl]propan-1-amine
CID 81290836
N-(2-cyclopropyl-1-quinolin-7-ylethyl)propan-1-amine
CID 81232087
N-ethyl-3-(furan-2-yl)-1-quinolin-7-ylpropan-1-amine
CID 105172573
N-[(4-methyl-2-pyridinyl)-quinolin-7-ylmethyl]ethanamine
CID 81228376

Frequently Asked Questions

What is the IUPAC name of N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine?
The IUPAC name of N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine (CID 81231383) is N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine?
The canonical SMILES for N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine is CCCNC(c1ccc2cccnc2c1)c1ccco1.
What is the InChIKey of N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine?
The InChIKey is NVAWUUVELVLHCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-2-9-19-17(16-6-4-11-20-16)14-8-7-13-5-3-10-18-15(13)12-14/h3-8,10-12,17,19H,2,9H2,1H3.
What are the key properties of N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine?
N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine has a molecular weight of 266.34 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[furan-2-yl(quinolin-7-yl)methyl]propan-1-amine is sourced from PubChem (CID 81231383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).