N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine

C16H18N2O — CID 102651527

IUPACN-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine
SMILESCCNC(C1=CCCO1)c1ccc2ncccc2c1
InChIInChI=1S/C16H18N2O/c1-2-17-16(15-6-4-10-19-15)13-7-8-14-12(11-13)5-3-9-18-14/h3,5-9,11,16-17H,2,4,10H2,1H3
InChIKeyHQPZKWCIPFJLRR-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.19
Rot. Bonds4

About N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine

N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine (PubChem CID 102651527) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine
PubChem CID102651527
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine
SMILESCCNC(C1=CCCO1)c1ccc2ncccc2c1
InChIInChI=1S/C16H18N2O/c1-2-17-16(15-6-4-10-19-15)13-7-8-14-12(11-13)5-3-9-18-14/h3,5-9,11,16-17H,2,4,10H2,1H3
InChIKeyHQPZKWCIPFJLRR-UHFFFAOYSA-N
XLogP3.19
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine
CID 102651581
N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine
CID 63095453
N-[(2-methylpyrazol-3-yl)-quinolin-6-ylmethyl]ethanamine
CID 63963933
N-[(2-bromofuran-3-yl)-quinolin-6-ylmethyl]ethanamine
CID 106858324
N-[(5-chlorothiophen-2-yl)-quinolin-6-ylmethyl]ethanamine
CID 78917810
N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine
CID 81232075
N-[(1-methylcyclopentyl)-quinolin-6-ylmethyl]ethanamine
CID 105021107
N-[oxan-3-yl(quinolin-6-yl)methyl]ethanamine
CID 81231200
N-ethyl-1-quinolin-6-ylbut-3-en-1-amine
CID 55181079
N-[2,3-dihydrofuran-5-yl-(2-methylpyrazol-3-yl)methyl]ethanamine
CID 102653774
N-[(4-methylmorpholin-2-yl)-quinolin-6-ylmethyl]ethanamine
CID 81229498
2-ethoxy-N-ethyl-2-methyl-1-quinolin-6-ylpropan-1-amine
CID 116726919

Frequently Asked Questions

What is the IUPAC name of N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine?
The IUPAC name of N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine (CID 102651527) is N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine.
What is the SMILES notation for N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine?
The canonical SMILES for N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine is CCNC(C1=CCCO1)c1ccc2ncccc2c1.
What is the InChIKey of N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine?
The InChIKey is HQPZKWCIPFJLRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-2-17-16(15-6-4-10-19-15)13-7-8-14-12(11-13)5-3-9-18-14/h3,5-9,11,16-17H,2,4,10H2,1H3.
What are the key properties of N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine?
N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine has a molecular weight of 254.33 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine is sourced from PubChem (CID 102651527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).