(2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine

C14H24N2 — CID 7036530

IUPAC(2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine
SMILESCCCC[C@H](CC)CNCc1ccccn1
InChIInChI=1S/C14H24N2/c1-3-5-8-13(4-2)11-15-12-14-9-6-7-10-16-14/h6-7,9-10,13,15H,3-5,8,11-12H2,1-2H3/t13-/m0/s1
InChIKeyNXQKSYDDMDZBNG-ZDUSSCGKSA-N
MW220.36 g/mol
LogP3.39
Rot. Bonds8

About (2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine

(2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine (PubChem CID 7036530) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is (2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine.

Molecular Properties

Compound Name(2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine
PubChem CID7036530
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name(2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine
SMILESCCCC[C@H](CC)CNCc1ccccn1
InChIInChI=1S/C14H24N2/c1-3-5-8-13(4-2)11-15-12-14-9-6-7-10-16-14/h6-7,9-10,13,15H,3-5,8,11-12H2,1-2H3/t13-/m0/s1
InChIKeyNXQKSYDDMDZBNG-ZDUSSCGKSA-N
XLogP3.39
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-ethylhexyl)-2-methyl-3-(pyridin-2-ylmethyl)guanidine;hydroiodide
CID 110969043
2-ethyl-N-[(6-methyl-2-pyridinyl)methyl]hexan-1-amine
CID 62323894
(2R)-N-benzyl-2-ethylhexan-1-amine
CID 11651454
1-N,2-N,2-N-tris(pyridin-2-ylmethyl)decane-1,2-diamine
CID 91282889
2-ethyl-N-[(2-ethylphenyl)methyl]hexan-1-amine
CID 63420299
2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine
CID 81407759
6-[(2-ethylhexylamino)methyl]pyridine-3-carboxylic acid
CID 107816753
2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine;hydrochloride
CID 17332283
2-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)hexan-1-amine
CID 60683059
2-N,2-N-diethyl-1-N-(pyridin-2-ylmethyl)propane-1,2-diamine
CID 115581231
1-cyclopropyl-N,N-dimethyl-N'-(pyridin-2-ylmethyl)ethane-1,2-diamine;hydrochloride
CID 115584771
N-(pyridin-2-ylmethyl)octan-2-amine
CID 43085262

Frequently Asked Questions

What is the IUPAC name of (2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine?
The IUPAC name of (2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine (CID 7036530) is (2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine.
What is the SMILES notation for (2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine?
The canonical SMILES for (2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine is CCCC[C@H](CC)CNCc1ccccn1.
What is the InChIKey of (2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine?
The InChIKey is NXQKSYDDMDZBNG-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H24N2/c1-3-5-8-13(4-2)11-15-12-14-9-6-7-10-16-14/h6-7,9-10,13,15H,3-5,8,11-12H2,1-2H3/t13-/m0/s1.
What are the key properties of (2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine?
(2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine has a molecular weight of 220.36 g/mol, XLogP of 3.39, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine is sourced from PubChem (CID 7036530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).