2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine

C13H22N2 — CID 82729735

IUPAC2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine
SMILESCCc1cccnc1C(N)C(CC)CC
InChIInChI=1S/C13H22N2/c1-4-10(5-2)12(14)13-11(6-3)8-7-9-15-13/h7-10,12H,4-6,14H2,1-3H3
InChIKeyNCZOAAZBSORTOI-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.08
Rot. Bonds5

About 2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine

2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine (PubChem CID 82729735) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is 2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine.

Molecular Properties

Compound Name2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine
PubChem CID82729735
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC Name2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine
SMILESCCc1cccnc1C(N)C(CC)CC
InChIInChI=1S/C13H22N2/c1-4-10(5-2)12(14)13-11(6-3)8-7-9-15-13/h7-10,12H,4-6,14H2,1-3H3
InChIKeyNCZOAAZBSORTOI-UHFFFAOYSA-N
XLogP3.08
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-chloro-2-pyridinyl)-2-ethylbutan-1-amine
CID 103443833
1-(3-ethyl-2-pyridinyl)-2-methylpentan-1-amine
CID 107896820
N,2-diethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine
CID 82730100
1-(3-ethyl-2-pyridinyl)-3-methylbut-2-en-1-amine
CID 82731279
2-ethoxy-1-(3-ethyl-2-pyridinyl)ethanamine
CID 82730504
1-(3-ethyl-2-pyridinyl)-2-pyridin-2-ylethanamine
CID 82729615
1-(3-ethyl-2-pyridinyl)-3-methylbut-3-en-1-amine
CID 82730508
(2-ethoxyphenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 82729596
(2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 82730897
1-(3-ethyl-2-pyridinyl)-5,5-dimethylhex-3-yn-1-amine
CID 114190337
1-(3-ethyl-2-pyridinyl)-2-methylpentan-1-ol
CID 107893026
(3-ethoxyphenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 82729975

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine?
The IUPAC name of 2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine (CID 82729735) is 2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine.
What is the SMILES notation for 2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine?
The canonical SMILES for 2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine is CCc1cccnc1C(N)C(CC)CC.
What is the InChIKey of 2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine?
The InChIKey is NCZOAAZBSORTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-4-10(5-2)12(14)13-11(6-3)8-7-9-15-13/h7-10,12H,4-6,14H2,1-3H3.
What are the key properties of 2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine?
2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine has a molecular weight of 206.33 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine is sourced from PubChem (CID 82729735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).