N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine

C17H18N2O — CID 81231183

IUPACN-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccoc1)c1cccc2cccnc12
InChIInChI=1S/C17H18N2O/c1-2-9-18-17(14-8-11-20-12-14)15-7-3-5-13-6-4-10-19-16(13)15/h3-8,10-12,17-18H,2,9H2,1H3
InChIKeyCDHRKUXPXROHJA-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.92
Rot. Bonds5

About N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine

N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine (PubChem CID 81231183) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine
PubChem CID81231183
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC NameN-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccoc1)c1cccc2cccnc12
InChIInChI=1S/C17H18N2O/c1-2-9-18-17(14-8-11-20-12-14)15-7-3-5-13-6-4-10-19-16(13)15/h3-8,10-12,17-18H,2,9H2,1H3
InChIKeyCDHRKUXPXROHJA-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

N-[pyridin-3-yl(quinolin-8-yl)methyl]propan-1-amine
CID 81209832
N-[(5-methylthiophen-3-yl)-quinolin-8-ylmethyl]propan-1-amine
CID 105155523
N-[furan-3-yl-(2-iodo-3-methylphenyl)methyl]propan-1-amine
CID 114030122
N-[furan-3-yl(quinolin-5-yl)methyl]ethanamine
CID 81232108
N-[(2-bromo-3-methylphenyl)-(furan-3-yl)methyl]propan-1-amine
CID 114024207
N-[quinolin-8-yl(1,2,5-thiadiazol-3-yl)methyl]propan-1-amine
CID 105172512
N-[3,4-dihydro-2H-pyran-5-yl(quinolin-8-yl)methyl]propan-1-amine
CID 105179292
N-[(4-bromothiophen-2-yl)-quinolin-8-ylmethyl]propan-1-amine
CID 81228406
N-(2-methoxy-1-quinolin-8-ylethyl)propan-1-amine
CID 81231808
N-[(2-fluoro-3-methoxyphenyl)-(furan-3-yl)methyl]propan-1-amine
CID 82808232
N-[(3-ethoxyphenyl)-(furan-3-yl)methyl]propan-1-amine
CID 63947558
N-[(5-iodothiophen-3-yl)-quinolin-8-ylmethyl]ethanamine
CID 105021278

Frequently Asked Questions

What is the IUPAC name of N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine?
The IUPAC name of N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine (CID 81231183) is N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine?
The canonical SMILES for N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine is CCCNC(c1ccoc1)c1cccc2cccnc12.
What is the InChIKey of N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine?
The InChIKey is CDHRKUXPXROHJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-2-9-18-17(14-8-11-20-12-14)15-7-3-5-13-6-4-10-19-16(13)15/h3-8,10-12,17-18H,2,9H2,1H3.
What are the key properties of N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine?
N-[furan-3-yl(quinolin-8-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-3-yl(quinolin-8-yl)methyl]propan-1-amine is sourced from PubChem (CID 81231183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).