N-(2-ethoxyethyl)-2-methylpentan-1-amine

C10H23NO — CID 43590656

IUPACN-(2-ethoxyethyl)-2-methylpentan-1-amine
SMILESCCCC(C)CNCCOCC
InChIInChI=1S/C10H23NO/c1-4-6-10(3)9-11-7-8-12-5-2/h10-11H,4-9H2,1-3H3
InChIKeyFYYWGNIAMDAVTF-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.05
Rot. Bonds8

About N-(2-ethoxyethyl)-2-methylpentan-1-amine

N-(2-ethoxyethyl)-2-methylpentan-1-amine (PubChem CID 43590656) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-2-methylpentan-1-amine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-2-methylpentan-1-amine
PubChem CID43590656
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC NameN-(2-ethoxyethyl)-2-methylpentan-1-amine
SMILESCCCC(C)CNCCOCC
InChIInChI=1S/C10H23NO/c1-4-6-10(3)9-11-7-8-12-5-2/h10-11H,4-9H2,1-3H3
InChIKeyFYYWGNIAMDAVTF-UHFFFAOYSA-N
XLogP2.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-2-methylpentan-1-amine?
The IUPAC name of N-(2-ethoxyethyl)-2-methylpentan-1-amine (CID 43590656) is N-(2-ethoxyethyl)-2-methylpentan-1-amine.
What is the SMILES notation for N-(2-ethoxyethyl)-2-methylpentan-1-amine?
The canonical SMILES for N-(2-ethoxyethyl)-2-methylpentan-1-amine is CCCC(C)CNCCOCC.
What is the InChIKey of N-(2-ethoxyethyl)-2-methylpentan-1-amine?
The InChIKey is FYYWGNIAMDAVTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-4-6-10(3)9-11-7-8-12-5-2/h10-11H,4-9H2,1-3H3.
What are the key properties of N-(2-ethoxyethyl)-2-methylpentan-1-amine?
N-(2-ethoxyethyl)-2-methylpentan-1-amine has a molecular weight of 173.30 g/mol, XLogP of 2.05, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-2-methylpentan-1-amine is sourced from PubChem (CID 43590656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).