3,3,6,6-tetramethylnonan-5-amine

C13H29N — CID 89328233

IUPAC3,3,6,6-tetramethylnonan-5-amine
SMILESCCCC(C)(C)C(N)CC(C)(C)CC
InChIInChI=1S/C13H29N/c1-7-9-13(5,6)11(14)10-12(3,4)8-2/h11H,7-10,14H2,1-6H3
InChIKeyNXGMSUFNBGWRHB-UHFFFAOYSA-N
MW199.38 g/mol
LogP3.97
Rot. Bonds6

About 3,3,6,6-tetramethylnonan-5-amine

3,3,6,6-tetramethylnonan-5-amine (PubChem CID 89328233) has the molecular formula C13H29N and a molecular weight of 199.38 g/mol. Its IUPAC name is 3,3,6,6-tetramethylnonan-5-amine.

Molecular Properties

Compound Name3,3,6,6-tetramethylnonan-5-amine
PubChem CID89328233
Molecular FormulaC13H29N
Molecular Weight199.38 g/mol
Exact Mass199.23
IUPAC Name3,3,6,6-tetramethylnonan-5-amine
SMILESCCCC(C)(C)C(N)CC(C)(C)CC
InChIInChI=1S/C13H29N/c1-7-9-13(5,6)11(14)10-12(3,4)8-2/h11H,7-10,14H2,1-6H3
InChIKeyNXGMSUFNBGWRHB-UHFFFAOYSA-N
XLogP3.97
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.38
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4,4-dimethylnonan-5-amine
CID 87513740
3,3-dimethylhexane-1,1-diamine
CID 88633791
(3S)-4-ethyl-4-methylheptan-3-amine
CID 163621922
4,4-dimethylicosan-5-amine;hydrobromide
CID 173152006
3,3-dimethylhexane
CID 11233
5-butyl-3,3-dimethylnonane
CID 123518865
tetrakis(3,3-dimethylpentane);methane
CID 159658641
3,3-dimethylpentane;methane
CID 158185076
3,3-dimethylpentane;propane
CID 90942978
3,3-dimethylpentane;2,2-dimethylpropane
CID 173299738
CID 123373948
CID 123373948
3,3,5-trimethylnonane
CID 53424862

Frequently Asked Questions

What is the IUPAC name of 3,3,6,6-tetramethylnonan-5-amine?
The IUPAC name of 3,3,6,6-tetramethylnonan-5-amine (CID 89328233) is 3,3,6,6-tetramethylnonan-5-amine.
What is the SMILES notation for 3,3,6,6-tetramethylnonan-5-amine?
The canonical SMILES for 3,3,6,6-tetramethylnonan-5-amine is CCCC(C)(C)C(N)CC(C)(C)CC.
What is the InChIKey of 3,3,6,6-tetramethylnonan-5-amine?
The InChIKey is NXGMSUFNBGWRHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N/c1-7-9-13(5,6)11(14)10-12(3,4)8-2/h11H,7-10,14H2,1-6H3.
What are the key properties of 3,3,6,6-tetramethylnonan-5-amine?
3,3,6,6-tetramethylnonan-5-amine has a molecular weight of 199.38 g/mol, XLogP of 3.97, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,6,6-tetramethylnonan-5-amine is sourced from PubChem (CID 89328233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).