1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine

C15H25N3O — CID 79795763

IUPAC1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine
SMILESCCC(N)Cc1ccc(OCCN2CCCC2)cn1
InChIInChI=1S/C15H25N3O/c1-2-13(16)11-14-5-6-15(12-17-14)19-10-9-18-7-3-4-8-18/h5-6,12-13H,2-4,7-11,16H2,1H3
InChIKeySRNOCLCWDYRZGS-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.84
Rot. Bonds7

About 1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine

1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine (PubChem CID 79795763) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine.

Molecular Properties

Compound Name1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine
PubChem CID79795763
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine
SMILESCCC(N)Cc1ccc(OCCN2CCCC2)cn1
InChIInChI=1S/C15H25N3O/c1-2-13(16)11-14-5-6-15(12-17-14)19-10-9-18-7-3-4-8-18/h5-6,12-13H,2-4,7-11,16H2,1H3
InChIKeySRNOCLCWDYRZGS-UHFFFAOYSA-N
XLogP1.84
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-(2-morpholin-4-ylethoxy)-2-pyridinyl]butan-2-amine
CID 79796010
1-(5-propoxy-2-pyridinyl)butan-2-amine
CID 79795245
N-[[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 79782097
N-[[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methyl]ethanamine
CID 79776328
1-[5-(2-cyclopropylethoxy)-2-pyridinyl]butan-2-amine
CID 79795250
1-[5-(3-ethylsulfonylpropoxy)-2-pyridinyl]butan-2-amine
CID 79795841
1-[5-(cyclobutylmethoxy)-2-pyridinyl]butan-2-amine
CID 79795847
(1S)-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-1-amine
CID 78937096
N-ethyl-1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]propan-1-amine
CID 115940076
2-methoxy-N-[[5-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]ethanamine
CID 79789474
1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
CID 803619
1-[5-(oxan-4-ylmethoxy)-2-pyridinyl]butan-2-amine
CID 79796421

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine?
The IUPAC name of 1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine (CID 79795763) is 1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine.
What is the SMILES notation for 1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine?
The canonical SMILES for 1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine is CCC(N)Cc1ccc(OCCN2CCCC2)cn1.
What is the InChIKey of 1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine?
The InChIKey is SRNOCLCWDYRZGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-2-13(16)11-14-5-6-15(12-17-14)19-10-9-18-7-3-4-8-18/h5-6,12-13H,2-4,7-11,16H2,1H3.
What are the key properties of 1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine?
1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine has a molecular weight of 263.38 g/mol, XLogP of 1.84, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]butan-2-amine is sourced from PubChem (CID 79795763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).