3-ethyl-3,5-dimethylhexan-2-amine

C10H23N — CID 146359872

IUPAC3-ethyl-3,5-dimethylhexan-2-amine
SMILESCCC(C)(CC(C)C)C(C)N
InChIInChI=1S/C10H23N/c1-6-10(5,9(4)11)7-8(2)3/h8-9H,6-7,11H2,1-5H3
InChIKeyWNNHAZKFESSNFG-UHFFFAOYSA-N
MW157.30 g/mol
LogP2.80
Rot. Bonds4

About 3-ethyl-3,5-dimethylhexan-2-amine

3-ethyl-3,5-dimethylhexan-2-amine (PubChem CID 146359872) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is 3-ethyl-3,5-dimethylhexan-2-amine.

Molecular Properties

Compound Name3-ethyl-3,5-dimethylhexan-2-amine
PubChem CID146359872
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC Name3-ethyl-3,5-dimethylhexan-2-amine
SMILESCCC(C)(CC(C)C)C(C)N
InChIInChI=1S/C10H23N/c1-6-10(5,9(4)11)7-8(2)3/h8-9H,6-7,11H2,1-5H3
InChIKeyWNNHAZKFESSNFG-UHFFFAOYSA-N
XLogP2.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethyl-2,3,5-trimethylhexane
CID 53428900
(4S)-2,4-dimethyl-4-propan-2-ylheptane
CID 58432708
2,5,5-trimethylheptan-4-amine
CID 115782662
4-ethyl-4-methylhexan-3-amine
CID 163866952
3-ethyl-2,5-dimethyl-3-propan-2-ylhexane
CID 57491485
4-[(2-ethyl-2,4-dimethylpentoxy)methyl]-2,4-dimethylhexane
CID 88745272
azane;3-methylpentane-2,3-diamine
CID 174323665
3-ethyl-2,3,6,6,7,7,8,8,10-nonamethylundecane
CID 123324624
3,5-dimethyl-3-propylhexan-2-ol
CID 20501854
1-chloro-3-ethyl-3,5-dimethylhexane
CID 123958572
3-amino-5-methylhexan-3-ol
CID 19828897
1-(2-methylbutan-2-yloxy)ethanamine
CID 23371049

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3,5-dimethylhexan-2-amine?
The IUPAC name of 3-ethyl-3,5-dimethylhexan-2-amine (CID 146359872) is 3-ethyl-3,5-dimethylhexan-2-amine.
What is the SMILES notation for 3-ethyl-3,5-dimethylhexan-2-amine?
The canonical SMILES for 3-ethyl-3,5-dimethylhexan-2-amine is CCC(C)(CC(C)C)C(C)N.
What is the InChIKey of 3-ethyl-3,5-dimethylhexan-2-amine?
The InChIKey is WNNHAZKFESSNFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N/c1-6-10(5,9(4)11)7-8(2)3/h8-9H,6-7,11H2,1-5H3.
What are the key properties of 3-ethyl-3,5-dimethylhexan-2-amine?
3-ethyl-3,5-dimethylhexan-2-amine has a molecular weight of 157.30 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3,5-dimethylhexan-2-amine is sourced from PubChem (CID 146359872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).