2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine

C18H24N2O — CID 103046085

IUPAC2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine
SMILESCCCNC1CC(Oc2cccc3ncccc23)C1(C)C
InChIInChI=1S/C18H24N2O/c1-4-10-20-16-12-17(18(16,2)3)21-15-9-5-8-14-13(15)7-6-11-19-14/h5-9,11,16-17,20H,4,10,12H2,1-3H3
InChIKeyWIUQZLSTQRGDJM-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.78
Rot. Bonds5

About 2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine

2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine (PubChem CID 103046085) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine
PubChem CID103046085
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine
SMILESCCCNC1CC(Oc2cccc3ncccc23)C1(C)C
InChIInChI=1S/C18H24N2O/c1-4-10-20-16-12-17(18(16,2)3)21-15-9-5-8-14-13(15)7-6-11-19-14/h5-9,11,16-17,20H,4,10,12H2,1-3H3
InChIKeyWIUQZLSTQRGDJM-UHFFFAOYSA-N
XLogP3.78
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-propyl-3-quinolin-5-yloxycyclobutan-1-amine
CID 103046094
N-propyl-3-quinolin-5-yloxycyclopentan-1-amine
CID 103044462
3-(2,6-difluorophenoxy)-2,2-dimethyl-N-propylcyclobutan-1-amine
CID 81267993
3-(2,5-difluorophenoxy)-2,2-dimethyl-N-propylcyclobutan-1-amine
CID 66351359
3-(3-ethoxyphenoxy)-2,2-dimethyl-N-propylcyclobutan-1-amine
CID 66352890
2,2-dimethyl-3-(3-methyl-2-nitrophenoxy)-N-propylcyclobutan-1-amine
CID 66358081
3-(2-bromo-4-chlorophenoxy)-2,2-dimethyl-N-propylcyclobutan-1-amine
CID 66357740
3-(4-bromo-2-fluorophenoxy)-2,2-dimethyl-N-propylcyclobutan-1-amine
CID 66358022
N,4-dimethyl-2-quinolin-5-yloxycyclohexan-1-amine
CID 103044511
N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine
CID 66358543
5-(3-chlorospiro[3.4]octan-1-yl)oxyquinoline
CID 103046070
5-(3-bromospiro[3.4]octan-1-yl)oxyquinoline
CID 103046075

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine?
The IUPAC name of 2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine (CID 103046085) is 2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine is CCCNC1CC(Oc2cccc3ncccc23)C1(C)C.
What is the InChIKey of 2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine?
The InChIKey is WIUQZLSTQRGDJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-4-10-20-16-12-17(18(16,2)3)21-15-9-5-8-14-13(15)7-6-11-19-14/h5-9,11,16-17,20H,4,10,12H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine?
2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine has a molecular weight of 284.40 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine is sourced from PubChem (CID 103046085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).