3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine

C13H22N2 — CID 105176719

IUPAC3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine
SMILESCCC(CC)CC(N)c1cccnc1C
InChIInChI=1S/C13H22N2/c1-4-11(5-2)9-13(14)12-7-6-8-15-10(12)3/h6-8,11,13H,4-5,9,14H2,1-3H3
InChIKeyCEFJDMBZDIYEMM-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.22
Rot. Bonds5

About 3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine

3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine (PubChem CID 105176719) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is 3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine.

Molecular Properties

Compound Name3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine
PubChem CID105176719
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC Name3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine
SMILESCCC(CC)CC(N)c1cccnc1C
InChIInChI=1S/C13H22N2/c1-4-11(5-2)9-13(14)12-7-6-8-15-10(12)3/h6-8,11,13H,4-5,9,14H2,1-3H3
InChIKeyCEFJDMBZDIYEMM-UHFFFAOYSA-N
XLogP3.22
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 ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-2-(2-methyl-3-pyridinyl)ethanol
CID 55263472
1-(2-methyl-3-pyridinyl)tridecan-1-amine
CID 105138527
(1S)-1-(2-methyl-3-pyridinyl)ethanamine
CID 94864826
ethane;(1S)-1-(2-methyl-3-pyridinyl)propan-1-ol
CID 144739559
3-ethyl-1-(2-methoxyphenyl)pentan-1-amine
CID 82919557
3-hexan-3-yl-2-methylpyridine
CID 143825062
2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine
CID 105087456
(1R)-2-amino-1-(2-methyl-3-pyridinyl)ethanol
CID 96635768
1-(2,3-dichlorophenyl)-3-ethylpentan-1-amine
CID 105028441
1-(2-methyl-3-pyridinyl)-2-(2-methyl-1,2,4-triazol-3-yl)ethanamine
CID 105159432
ethane;3-heptan-4-yl-2-methylpyridine
CID 143825065
3-[(1S)-1-aminopropyl]pyridin-2-amine;hydrochloride
CID 171230912

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine?
The IUPAC name of 3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine (CID 105176719) is 3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine.
What is the SMILES notation for 3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine?
The canonical SMILES for 3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine is CCC(CC)CC(N)c1cccnc1C.
What is the InChIKey of 3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine?
The InChIKey is CEFJDMBZDIYEMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-4-11(5-2)9-13(14)12-7-6-8-15-10(12)3/h6-8,11,13H,4-5,9,14H2,1-3H3.
What are the key properties of 3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine?
3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine has a molecular weight of 206.33 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine is sourced from PubChem (CID 105176719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).