2,4-dimethylhexan-3-amine;ethane

C10H25N — CID 143534901

IUPAC2,4-dimethylhexan-3-amine;ethane
SMILESCC.CCC(C)C(N)C(C)C
InChIInChI=1S/C8H19N.C2H6/c1-5-7(4)8(9)6(2)3;1-2/h6-8H,5,9H2,1-4H3;1-2H3
InChIKeyRANVGLNPLPOZJT-UHFFFAOYSA-N
MW159.32 g/mol
LogP3.04
Rot. Bonds3

About 2,4-dimethylhexan-3-amine;ethane

2,4-dimethylhexan-3-amine;ethane (PubChem CID 143534901) has the molecular formula C10H25N and a molecular weight of 159.32 g/mol. Its IUPAC name is 2,4-dimethylhexan-3-amine;ethane.

Molecular Properties

Compound Name2,4-dimethylhexan-3-amine;ethane
PubChem CID143534901
Molecular FormulaC10H25N
Molecular Weight159.32 g/mol
Exact Mass159.20
IUPAC Name2,4-dimethylhexan-3-amine;ethane
SMILESCC.CCC(C)C(N)C(C)C
InChIInChI=1S/C8H19N.C2H6/c1-5-7(4)8(9)6(2)3;1-2/h6-8H,5,9H2,1-4H3;1-2H3
InChIKeyRANVGLNPLPOZJT-UHFFFAOYSA-N
XLogP3.04
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.32
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylhexan-3-amine;ethane?
The IUPAC name of 2,4-dimethylhexan-3-amine;ethane (CID 143534901) is 2,4-dimethylhexan-3-amine;ethane.
What is the SMILES notation for 2,4-dimethylhexan-3-amine;ethane?
The canonical SMILES for 2,4-dimethylhexan-3-amine;ethane is CC.CCC(C)C(N)C(C)C.
What is the InChIKey of 2,4-dimethylhexan-3-amine;ethane?
The InChIKey is RANVGLNPLPOZJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N.C2H6/c1-5-7(4)8(9)6(2)3;1-2/h6-8H,5,9H2,1-4H3;1-2H3.
What are the key properties of 2,4-dimethylhexan-3-amine;ethane?
2,4-dimethylhexan-3-amine;ethane has a molecular weight of 159.32 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylhexan-3-amine;ethane is sourced from PubChem (CID 143534901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).