1-ethoxy-N,3,3-trimethylpentan-2-amine

C10H23NO — CID 105007892

IUPAC1-ethoxy-N,3,3-trimethylpentan-2-amine
SMILESCCOCC(NC)C(C)(C)CC
InChIInChI=1S/C10H23NO/c1-6-10(3,4)9(11-5)8-12-7-2/h9,11H,6-8H2,1-5H3
InChIKeyBLDVCPVFCQLYIA-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.05
Rot. Bonds6

About 1-ethoxy-N,3,3-trimethylpentan-2-amine

1-ethoxy-N,3,3-trimethylpentan-2-amine (PubChem CID 105007892) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 1-ethoxy-N,3,3-trimethylpentan-2-amine.

Molecular Properties

Compound Name1-ethoxy-N,3,3-trimethylpentan-2-amine
PubChem CID105007892
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name1-ethoxy-N,3,3-trimethylpentan-2-amine
SMILESCCOCC(NC)C(C)(C)CC
InChIInChI=1S/C10H23NO/c1-6-10(3,4)9(11-5)8-12-7-2/h9,11H,6-8H2,1-5H3
InChIKeyBLDVCPVFCQLYIA-UHFFFAOYSA-N
XLogP2.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-N,3,3-trimethylpentan-2-amine?
The IUPAC name of 1-ethoxy-N,3,3-trimethylpentan-2-amine (CID 105007892) is 1-ethoxy-N,3,3-trimethylpentan-2-amine.
What is the SMILES notation for 1-ethoxy-N,3,3-trimethylpentan-2-amine?
The canonical SMILES for 1-ethoxy-N,3,3-trimethylpentan-2-amine is CCOCC(NC)C(C)(C)CC.
What is the InChIKey of 1-ethoxy-N,3,3-trimethylpentan-2-amine?
The InChIKey is BLDVCPVFCQLYIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-6-10(3,4)9(11-5)8-12-7-2/h9,11H,6-8H2,1-5H3.
What are the key properties of 1-ethoxy-N,3,3-trimethylpentan-2-amine?
1-ethoxy-N,3,3-trimethylpentan-2-amine has a molecular weight of 173.30 g/mol, XLogP of 2.05, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N,3,3-trimethylpentan-2-amine is sourced from PubChem (CID 105007892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).