N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine

C18H24N2O — CID 116714935

IUPACN-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine
SMILESCCCNC(c1ccc2ncccc2c1)C1(OC)CCC1
InChIInChI=1S/C18H24N2O/c1-3-11-20-17(18(21-2)9-5-10-18)15-7-8-16-14(13-15)6-4-12-19-16/h4,6-8,12-13,17,20H,3,5,9-11H2,1-2H3
InChIKeyUMYZOJIILZNQHN-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.84
Rot. Bonds6

About N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine

N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine (PubChem CID 116714935) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine.

Molecular Properties

Compound NameN-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine
PubChem CID116714935
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine
SMILESCCCNC(c1ccc2ncccc2c1)C1(OC)CCC1
InChIInChI=1S/C18H24N2O/c1-3-11-20-17(18(21-2)9-5-10-18)15-7-8-16-14(13-15)6-4-12-19-16/h4,6-8,12-13,17,20H,3,5,9-11H2,1-2H3
InChIKeyUMYZOJIILZNQHN-UHFFFAOYSA-N
XLogP3.84
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-methoxycyclobutyl)-(4-methoxyphenyl)methyl]propan-1-amine
CID 116714736
N-[(3,4-dimethoxyphenyl)-(1-methoxycyclobutyl)methyl]propan-1-amine
CID 116714856
(1-methoxycyclopentyl)-quinolin-6-ylmethanamine
CID 104610565
N-[(1-methylcyclopentyl)-quinolin-6-ylmethyl]ethanamine
CID 105021107
N-[(1-methoxycyclobutyl)-(2-methylquinolin-6-yl)methyl]ethanamine
CID 116714645
N-[(4-chloro-3-methoxyphenyl)-(1-methoxycyclobutyl)methyl]propan-1-amine
CID 116714786
N-[cyclohexyl(quinolin-6-yl)methyl]propan-1-amine
CID 63095807
N-propyl-1-quinolin-6-ylethane-1,2-diamine
CID 63967677
3,3,3-trifluoro-N-propyl-1-quinolin-6-ylpropan-1-amine
CID 81231447
N-[(1-methoxycycloheptyl)-(5-methylthiophen-3-yl)methyl]propan-1-amine
CID 116770453
N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine
CID 81232075
N-[quinolin-6-yl(thiadiazol-5-yl)methyl]propan-1-amine
CID 105172388

Frequently Asked Questions

What is the IUPAC name of N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine?
The IUPAC name of N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine (CID 116714935) is N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine.
What is the SMILES notation for N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine?
The canonical SMILES for N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine is CCCNC(c1ccc2ncccc2c1)C1(OC)CCC1.
What is the InChIKey of N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine?
The InChIKey is UMYZOJIILZNQHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-3-11-20-17(18(21-2)9-5-10-18)15-7-8-16-14(13-15)6-4-12-19-16/h4,6-8,12-13,17,20H,3,5,9-11H2,1-2H3.
What are the key properties of N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine?
N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine has a molecular weight of 284.40 g/mol, XLogP of 3.84, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methoxycyclobutyl)-quinolin-6-ylmethyl]propan-1-amine is sourced from PubChem (CID 116714935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).