(2R)-N-benzyl-2-ethylhexan-1-amine

C15H25N — CID 11651454

IUPAC(2R)-N-benzyl-2-ethylhexan-1-amine
SMILESCCCC[C@@H](CC)CNCc1ccccc1
InChIInChI=1S/C15H25N/c1-3-5-9-14(4-2)12-16-13-15-10-7-6-8-11-15/h6-8,10-11,14,16H,3-5,9,12-13H2,1-2H3/t14-/m1/s1
InChIKeyYVUAGSOPUFGKGF-CQSZACIVSA-N
MW219.37 g/mol
LogP3.99
Rot. Bonds8

About (2R)-N-benzyl-2-ethylhexan-1-amine

(2R)-N-benzyl-2-ethylhexan-1-amine (PubChem CID 11651454) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is (2R)-N-benzyl-2-ethylhexan-1-amine.

Molecular Properties

Compound Name(2R)-N-benzyl-2-ethylhexan-1-amine
PubChem CID11651454
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name(2R)-N-benzyl-2-ethylhexan-1-amine
SMILESCCCC[C@@H](CC)CNCc1ccccc1
InChIInChI=1S/C15H25N/c1-3-5-9-14(4-2)12-16-13-15-10-7-6-8-11-15/h6-8,10-11,14,16H,3-5,9,12-13H2,1-2H3/t14-/m1/s1
InChIKeyYVUAGSOPUFGKGF-CQSZACIVSA-N
XLogP3.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2R)-N-benzyl-2-ethylhexan-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

2-ethyl-N-[(2-ethylphenyl)methyl]hexan-1-amine
CID 63420299
1-(benzylamino)octan-2-ol
CID 71341698
(2S)-1-(benzylamino)dodecan-2-ol
CID 98082078
1-(benzylamino)decan-2-ol
CID 42614665
N-(2,2-difluoro-2-phenylethyl)-2-ethylhexan-1-amine
CID 107820052
(2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine
CID 7036530
N-benzyl-2-methylicosan-1-amine
CID 67811057
N-[bis(2-ethylhexoxy)phosphorylmethyl]-1-phenylmethanamine
CID 15389105
2-ethyl-N-[(5-phenyl-2H-triazol-4-yl)methyl]hexan-1-amine
CID 63642785
N-[3-(2-ethylhexylamino)propyl]-N'-[[4-[3-[4-[[3-[3-(2-ethylhexylamino)propylamino]propylamino]methyl]phenyl]phenyl]phenyl]methyl]propane-1,3-diamine
CID 146319494
2,6-dibromo-4-[(2-ethylhexylamino)methyl]phenol
CID 103602726
N-[(2,3-dimethylphenyl)methyl]-2-ethylhexan-1-amine
CID 55027033

Frequently Asked Questions

What is the IUPAC name of (2R)-N-benzyl-2-ethylhexan-1-amine?
The IUPAC name of (2R)-N-benzyl-2-ethylhexan-1-amine (CID 11651454) is (2R)-N-benzyl-2-ethylhexan-1-amine.
What is the SMILES notation for (2R)-N-benzyl-2-ethylhexan-1-amine?
The canonical SMILES for (2R)-N-benzyl-2-ethylhexan-1-amine is CCCC[C@@H](CC)CNCc1ccccc1.
What is the InChIKey of (2R)-N-benzyl-2-ethylhexan-1-amine?
The InChIKey is YVUAGSOPUFGKGF-CQSZACIVSA-N. The full InChI is InChI=1S/C15H25N/c1-3-5-9-14(4-2)12-16-13-15-10-7-6-8-11-15/h6-8,10-11,14,16H,3-5,9,12-13H2,1-2H3/t14-/m1/s1.
What are the key properties of (2R)-N-benzyl-2-ethylhexan-1-amine?
(2R)-N-benzyl-2-ethylhexan-1-amine has a molecular weight of 219.37 g/mol, XLogP of 3.99, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-benzyl-2-ethylhexan-1-amine is sourced from PubChem (CID 11651454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).