(1-methoxycyclopentyl)-quinolin-6-ylmethanamine

C16H20N2O — CID 104610565

IUPAC(1-methoxycyclopentyl)-quinolin-6-ylmethanamine
SMILESCOC1(C(N)c2ccc3ncccc3c2)CCCC1
InChIInChI=1S/C16H20N2O/c1-19-16(8-2-3-9-16)15(17)13-6-7-14-12(11-13)5-4-10-18-14/h4-7,10-11,15H,2-3,8-9,17H2,1H3
InChIKeyYLGCXAGANFEDCJ-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.19
Rot. Bonds3

About (1-methoxycyclopentyl)-quinolin-6-ylmethanamine

(1-methoxycyclopentyl)-quinolin-6-ylmethanamine (PubChem CID 104610565) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is (1-methoxycyclopentyl)-quinolin-6-ylmethanamine.

Molecular Properties

Compound Name(1-methoxycyclopentyl)-quinolin-6-ylmethanamine
PubChem CID104610565
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name(1-methoxycyclopentyl)-quinolin-6-ylmethanamine
SMILESCOC1(C(N)c2ccc3ncccc3c2)CCCC1
InChIInChI=1S/C16H20N2O/c1-19-16(8-2-3-9-16)15(17)13-6-7-14-12(11-13)5-4-10-18-14/h4-7,10-11,15H,2-3,8-9,17H2,1H3
InChIKeyYLGCXAGANFEDCJ-UHFFFAOYSA-N
XLogP3.19
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-methoxycyclopentyl)-quinolin-6-ylmethanamine?
The IUPAC name of (1-methoxycyclopentyl)-quinolin-6-ylmethanamine (CID 104610565) is (1-methoxycyclopentyl)-quinolin-6-ylmethanamine.
What is the SMILES notation for (1-methoxycyclopentyl)-quinolin-6-ylmethanamine?
The canonical SMILES for (1-methoxycyclopentyl)-quinolin-6-ylmethanamine is COC1(C(N)c2ccc3ncccc3c2)CCCC1.
What is the InChIKey of (1-methoxycyclopentyl)-quinolin-6-ylmethanamine?
The InChIKey is YLGCXAGANFEDCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-19-16(8-2-3-9-16)15(17)13-6-7-14-12(11-13)5-4-10-18-14/h4-7,10-11,15H,2-3,8-9,17H2,1H3.
What are the key properties of (1-methoxycyclopentyl)-quinolin-6-ylmethanamine?
(1-methoxycyclopentyl)-quinolin-6-ylmethanamine has a molecular weight of 256.35 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycyclopentyl)-quinolin-6-ylmethanamine is sourced from PubChem (CID 104610565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).