N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine

C18H24N2O — CID 107387842

IUPACN-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine
SMILESCC(C)NCCC1(Oc2cnc3ccccc3c2)CCC1
InChIInChI=1S/C18H24N2O/c1-14(2)19-11-10-18(8-5-9-18)21-16-12-15-6-3-4-7-17(15)20-13-16/h3-4,6-7,12-14,19H,5,8-11H2,1-2H3
InChIKeyDLQPFHWXQFQLHF-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.92
Rot. Bonds6

About N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine

N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine (PubChem CID 107387842) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine
PubChem CID107387842
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine
SMILESCC(C)NCCC1(Oc2cnc3ccccc3c2)CCC1
InChIInChI=1S/C18H24N2O/c1-14(2)19-11-10-18(8-5-9-18)21-16-12-15-6-3-4-7-17(15)20-13-16/h3-4,6-7,12-14,19H,5,8-11H2,1-2H3
InChIKeyDLQPFHWXQFQLHF-UHFFFAOYSA-N
XLogP3.92
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 ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine?
The IUPAC name of N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine (CID 107387842) is N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine is CC(C)NCCC1(Oc2cnc3ccccc3c2)CCC1.
What is the InChIKey of N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine?
The InChIKey is DLQPFHWXQFQLHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-14(2)19-11-10-18(8-5-9-18)21-16-12-15-6-3-4-7-17(15)20-13-16/h3-4,6-7,12-14,19H,5,8-11H2,1-2H3.
What are the key properties of N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine?
N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine has a molecular weight of 284.40 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-quinolin-3-yloxycyclobutyl)ethyl]propan-2-amine is sourced from PubChem (CID 107387842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).