N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine

C15H24N2O — CID 103274268

IUPACN-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine
SMILESCc1ncccc1OC1(CCNC(C)C)CCC1
InChIInChI=1S/C15H24N2O/c1-12(2)16-11-9-15(7-5-8-15)18-14-6-4-10-17-13(14)3/h4,6,10,12,16H,5,7-9,11H2,1-3H3
InChIKeyYMWOAEDAYSLFPS-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.08
Rot. Bonds6

About N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine

N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine (PubChem CID 103274268) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine
PubChem CID103274268
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine
SMILESCc1ncccc1OC1(CCNC(C)C)CCC1
InChIInChI=1S/C15H24N2O/c1-12(2)16-11-9-15(7-5-8-15)18-14-6-4-10-17-13(14)3/h4,6,10,12,16H,5,7-9,11H2,1-3H3
InChIKeyYMWOAEDAYSLFPS-UHFFFAOYSA-N
XLogP3.08
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine?
The IUPAC name of N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine (CID 103274268) is N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine.
What is the SMILES notation for N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine?
The canonical SMILES for N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine is Cc1ncccc1OC1(CCNC(C)C)CCC1.
What is the InChIKey of N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine?
The InChIKey is YMWOAEDAYSLFPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12(2)16-11-9-15(7-5-8-15)18-14-6-4-10-17-13(14)3/h4,6,10,12,16H,5,7-9,11H2,1-3H3.
What are the key properties of N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine?
N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine has a molecular weight of 248.37 g/mol, XLogP of 3.08, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-[(2-methyl-3-pyridinyl)oxy]cyclobutyl]ethyl]propan-2-amine is sourced from PubChem (CID 103274268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).