2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine

C15H25N3 — CID 81170607

IUPAC2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine
SMILESCCN(CCC1(CN)CCC1)Cc1ccccn1
InChIInChI=1S/C15H25N3/c1-2-18(12-14-6-3-4-10-17-14)11-9-15(13-16)7-5-8-15/h3-4,6,10H,2,5,7-9,11-13,16H2,1H3
InChIKeyJXZWOGFTGPOFNA-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.42
Rot. Bonds7

About 2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine

2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine (PubChem CID 81170607) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine
PubChem CID81170607
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine
SMILESCCN(CCC1(CN)CCC1)Cc1ccccn1
InChIInChI=1S/C15H25N3/c1-2-18(12-14-6-3-4-10-17-14)11-9-15(13-16)7-5-8-15/h3-4,6,10H,2,5,7-9,11-13,16H2,1H3
InChIKeyJXZWOGFTGPOFNA-UHFFFAOYSA-N
XLogP2.42
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(aminomethyl)cyclohexyl]-N-methyl-N-(pyridin-2-ylmethyl)ethanamine
CID 104678721
N'-[2-[2-aminoethyl(pyridin-2-ylmethyl)amino]ethyl]-N'-(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 141183733
[ethyl(pyridin-2-ylmethyl)amino]methanol
CID 20707216
2-[1-(aminomethyl)cyclobutyl]-N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)acetamide
CID 81172532
3-[ethyl(pyridin-2-ylmethyl)amino]propanoic acid
CID 61010631
N-[[1-(aminomethyl)cyclobutyl]methyl]-2-pyridin-2-ylethanamine
CID 115245931
2,2-dimethyl-N'-propyl-N'-(pyridin-2-ylmethyl)propane-1,3-diamine
CID 79668381
1-[2-[methyl(pyridin-2-ylmethyl)amino]ethyl]cyclopentan-1-amine
CID 64677728
N-[[4-(aminomethyl)oxan-4-yl]methyl]-N-methyl-1-pyridin-2-ylmethanamine
CID 62390958
copper;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 130339696
(2R)-1-N,1-N-bis(pyridin-2-ylmethyl)butane-1,2-diamine
CID 102044881
N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine
CID 62257869

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine?
The IUPAC name of 2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine (CID 81170607) is 2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine.
What is the SMILES notation for 2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine?
The canonical SMILES for 2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine is CCN(CCC1(CN)CCC1)Cc1ccccn1.
What is the InChIKey of 2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine?
The InChIKey is JXZWOGFTGPOFNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-2-18(12-14-6-3-4-10-17-14)11-9-15(13-16)7-5-8-15/h3-4,6,10H,2,5,7-9,11-13,16H2,1H3.
What are the key properties of 2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine?
2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine has a molecular weight of 247.39 g/mol, XLogP of 2.42, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)cyclobutyl]-N-ethyl-N-(pyridin-2-ylmethyl)ethanamine is sourced from PubChem (CID 81170607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).