4,8-dimethylnonan-2-amine

C11H25N — CID 83168373

IUPAC4,8-dimethylnonan-2-amine
SMILESCC(C)CCCC(C)CC(C)N
InChIInChI=1S/C11H25N/c1-9(2)6-5-7-10(3)8-11(4)12/h9-11H,5-8,12H2,1-4H3
InChIKeyGNKUSJYSVILDSR-UHFFFAOYSA-N
MW171.33 g/mol
LogP3.19
Rot. Bonds6

About 4,8-dimethylnonan-2-amine

4,8-dimethylnonan-2-amine (PubChem CID 83168373) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is 4,8-dimethylnonan-2-amine.

Molecular Properties

Compound Name4,8-dimethylnonan-2-amine
PubChem CID83168373
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC Name4,8-dimethylnonan-2-amine
SMILESCC(C)CCCC(C)CC(C)N
InChIInChI=1S/C11H25N/c1-9(2)6-5-7-10(3)8-11(4)12/h9-11H,5-8,12H2,1-4H3
InChIKeyGNKUSJYSVILDSR-UHFFFAOYSA-N
XLogP3.19
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4,8-dimethylnonan-2-amine?
The IUPAC name of 4,8-dimethylnonan-2-amine (CID 83168373) is 4,8-dimethylnonan-2-amine.
What is the SMILES notation for 4,8-dimethylnonan-2-amine?
The canonical SMILES for 4,8-dimethylnonan-2-amine is CC(C)CCCC(C)CC(C)N.
What is the InChIKey of 4,8-dimethylnonan-2-amine?
The InChIKey is GNKUSJYSVILDSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N/c1-9(2)6-5-7-10(3)8-11(4)12/h9-11H,5-8,12H2,1-4H3.
What are the key properties of 4,8-dimethylnonan-2-amine?
4,8-dimethylnonan-2-amine has a molecular weight of 171.33 g/mol, XLogP of 3.19, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,8-dimethylnonan-2-amine is sourced from PubChem (CID 83168373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).