(5R)-N,5,6,8-tetramethylnonan-1-amine

C13H29N — CID 174103380

IUPAC(5R)-N,5,6,8-tetramethylnonan-1-amine
SMILESCNCCCC[C@@H](C)C(C)CC(C)C
InChIInChI=1S/C13H29N/c1-11(2)10-13(4)12(3)8-6-7-9-14-5/h11-14H,6-10H2,1-5H3/t12-,13?/m1/s1
InChIKeyKWLFMGUEXQXSSX-PZORYLMUSA-N
MW199.38 g/mol
LogP3.69
Rot. Bonds8

About (5R)-N,5,6,8-tetramethylnonan-1-amine

(5R)-N,5,6,8-tetramethylnonan-1-amine (PubChem CID 174103380) has the molecular formula C13H29N and a molecular weight of 199.38 g/mol. Its IUPAC name is (5R)-N,5,6,8-tetramethylnonan-1-amine.

Molecular Properties

Compound Name(5R)-N,5,6,8-tetramethylnonan-1-amine
PubChem CID174103380
Molecular FormulaC13H29N
Molecular Weight199.38 g/mol
Exact Mass199.23
IUPAC Name(5R)-N,5,6,8-tetramethylnonan-1-amine
SMILESCNCCCC[C@@H](C)C(C)CC(C)C
InChIInChI=1S/C13H29N/c1-11(2)10-13(4)12(3)8-6-7-9-14-5/h11-14H,6-10H2,1-5H3/t12-,13?/m1/s1
InChIKeyKWLFMGUEXQXSSX-PZORYLMUSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.38
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N,5-dimethylhexan-1-amine;ethane
CID 142540507
N,6-dimethylheptan-1-amine;ethane
CID 169159475
2,4,5-trimethyldodecane
CID 123969029
11-ethyl-2,4,5-trimethyltridecane
CID 91241452
(2S)-3-methyl-6-(methylamino)hexan-2-ol
CID 172612880
2-[4-(methylamino)butyl]propane-1,3-diol
CID 59502430
1-N,5-N,7-N-trimethyloctane-1,5,7-triamine
CID 174431293
6-ethyl-N,5,8,9,10,11,16-heptamethyl-14-propylheptadecan-1-amine
CID 126684746
(5R)-N,5-dimethylnonan-1-amine
CID 130290865
5-methyl-N-(4-methylpentan-2-yl)hexan-1-amine
CID 115324441
N,3,5-trimethylhexan-2-amine
CID 60995864
N,12-dimethylpentadecan-1-amine
CID 174486923

Frequently Asked Questions

What is the IUPAC name of (5R)-N,5,6,8-tetramethylnonan-1-amine?
The IUPAC name of (5R)-N,5,6,8-tetramethylnonan-1-amine (CID 174103380) is (5R)-N,5,6,8-tetramethylnonan-1-amine.
What is the SMILES notation for (5R)-N,5,6,8-tetramethylnonan-1-amine?
The canonical SMILES for (5R)-N,5,6,8-tetramethylnonan-1-amine is CNCCCC[C@@H](C)C(C)CC(C)C.
What is the InChIKey of (5R)-N,5,6,8-tetramethylnonan-1-amine?
The InChIKey is KWLFMGUEXQXSSX-PZORYLMUSA-N. The full InChI is InChI=1S/C13H29N/c1-11(2)10-13(4)12(3)8-6-7-9-14-5/h11-14H,6-10H2,1-5H3/t12-,13?/m1/s1.
What are the key properties of (5R)-N,5,6,8-tetramethylnonan-1-amine?
(5R)-N,5,6,8-tetramethylnonan-1-amine has a molecular weight of 199.38 g/mol, XLogP of 3.69, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-N,5,6,8-tetramethylnonan-1-amine is sourced from PubChem (CID 174103380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).