ethanol;2,3,4-trimethylpentan-3-amine

C10H25NO — CID 175160017

IUPACethanol;2,3,4-trimethylpentan-3-amine
SMILESCC(C)C(C)(N)C(C)C.CCO
InChIInChI=1S/C8H19N.C2H6O/c1-6(2)8(5,9)7(3)4;1-2-3/h6-7H,9H2,1-5H3;3H,2H2,1H3
InChIKeyFQPPVYJDZSFUEW-UHFFFAOYSA-N
MW175.32 g/mol
LogP2.01
Rot. Bonds2

About ethanol;2,3,4-trimethylpentan-3-amine

ethanol;2,3,4-trimethylpentan-3-amine (PubChem CID 175160017) has the molecular formula C10H25NO and a molecular weight of 175.32 g/mol. Its IUPAC name is ethanol;2,3,4-trimethylpentan-3-amine.

Molecular Properties

Compound Nameethanol;2,3,4-trimethylpentan-3-amine
PubChem CID175160017
Molecular FormulaC10H25NO
Molecular Weight175.32 g/mol
Exact Mass175.19
IUPAC Nameethanol;2,3,4-trimethylpentan-3-amine
SMILESCC(C)C(C)(N)C(C)C.CCO
InChIInChI=1S/C8H19N.C2H6O/c1-6(2)8(5,9)7(3)4;1-2-3/h6-7H,9H2,1-5H3;3H,2H2,1H3
InChIKeyFQPPVYJDZSFUEW-UHFFFAOYSA-N
XLogP2.01
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.32
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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hexane;2,3,4-trimethylpentan-3-amine
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N,N-dimethylmethanamine;2,3,4-trimethylpentan-3-amine
CID 87751828
methanesulfonic acid;2,3,4-trimethylpentan-3-amine
CID 173156179
potassium;carbonic acid;hydride;2,3,4-trimethylpentan-3-amine
CID 174931544
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CID 157184290
2-amino-2-methylpropane-1,3-diol;propan-2-ol
CID 18519501
ethanol;methanamine
CID 174381315
3-amino-2,3-dimethylbutan-1-ol;hydrochloride
CID 173013656
(2,3-dimethylbutan-2-ylamino)methanol
CID 54319920
3-amino-3-methylpentan-2-ol
CID 159077240
ethanol;propane-1,2-diamine
CID 161334035

Frequently Asked Questions

What is the IUPAC name of ethanol;2,3,4-trimethylpentan-3-amine?
The IUPAC name of ethanol;2,3,4-trimethylpentan-3-amine (CID 175160017) is ethanol;2,3,4-trimethylpentan-3-amine.
What is the SMILES notation for ethanol;2,3,4-trimethylpentan-3-amine?
The canonical SMILES for ethanol;2,3,4-trimethylpentan-3-amine is CC(C)C(C)(N)C(C)C.CCO.
What is the InChIKey of ethanol;2,3,4-trimethylpentan-3-amine?
The InChIKey is FQPPVYJDZSFUEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N.C2H6O/c1-6(2)8(5,9)7(3)4;1-2-3/h6-7H,9H2,1-5H3;3H,2H2,1H3.
What are the key properties of ethanol;2,3,4-trimethylpentan-3-amine?
ethanol;2,3,4-trimethylpentan-3-amine has a molecular weight of 175.32 g/mol, XLogP of 2.01, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;2,3,4-trimethylpentan-3-amine is sourced from PubChem (CID 175160017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).