5-ethoxy-N-ethyl-2-methylpentan-1-amine

C10H23NO — CID 64665808

IUPAC5-ethoxy-N-ethyl-2-methylpentan-1-amine
SMILESCCNCC(C)CCCOCC
InChIInChI=1S/C10H23NO/c1-4-11-9-10(3)7-6-8-12-5-2/h10-11H,4-9H2,1-3H3
InChIKeyODKKZEOSKMXRAP-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.05
Rot. Bonds8

About 5-ethoxy-N-ethyl-2-methylpentan-1-amine

5-ethoxy-N-ethyl-2-methylpentan-1-amine (PubChem CID 64665808) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 5-ethoxy-N-ethyl-2-methylpentan-1-amine.

Molecular Properties

Compound Name5-ethoxy-N-ethyl-2-methylpentan-1-amine
PubChem CID64665808
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name5-ethoxy-N-ethyl-2-methylpentan-1-amine
SMILESCCNCC(C)CCCOCC
InChIInChI=1S/C10H23NO/c1-4-11-9-10(3)7-6-8-12-5-2/h10-11H,4-9H2,1-3H3
InChIKeyODKKZEOSKMXRAP-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'}

Analyze 5-ethoxy-N-ethyl-2-methylpentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-ethoxy-N-ethyl-2,3-dimethylhexan-1-amine
CID 81015252
2-tert-butyl-5-ethoxy-N-ethylpentan-1-amine
CID 83138911
N-butyl-4-ethoxy-2-methylbutan-1-amine
CID 156824586
N,N'-diethyl-2-methylpentane-1,5-diamine;molecular hydrogen
CID 142254763
5-ethoxy-N-ethyl-2-phenylpentan-1-amine
CID 65430782
(2R)-5-ethoxy-N-methylpentan-2-amine
CID 93424576
1-N,5-N-diethyl-2-methylhexane-1,5-diamine
CID 129202816
N-(3-ethoxypropyl)-2-methyl-3-methylsulfanylpropan-1-amine
CID 65175780
N-ethyl-2-methylbutane-1,4-diamine
CID 79001608
1-ethoxy-N,5-diethylheptan-4-amine
CID 105168474
N-ethyl-2-methyl-5-methylsulfonylpentan-1-amine
CID 63195916
2-[(4-chlorophenyl)methyl]-5-ethoxy-N-ethylpentan-1-amine
CID 65180803

Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-N-ethyl-2-methylpentan-1-amine?
The IUPAC name of 5-ethoxy-N-ethyl-2-methylpentan-1-amine (CID 64665808) is 5-ethoxy-N-ethyl-2-methylpentan-1-amine.
What is the SMILES notation for 5-ethoxy-N-ethyl-2-methylpentan-1-amine?
The canonical SMILES for 5-ethoxy-N-ethyl-2-methylpentan-1-amine is CCNCC(C)CCCOCC.
What is the InChIKey of 5-ethoxy-N-ethyl-2-methylpentan-1-amine?
The InChIKey is ODKKZEOSKMXRAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-4-11-9-10(3)7-6-8-12-5-2/h10-11H,4-9H2,1-3H3.
What are the key properties of 5-ethoxy-N-ethyl-2-methylpentan-1-amine?
5-ethoxy-N-ethyl-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 5-ethoxy-N-ethyl-2-methylpentan-1-amine is sourced from PubChem (CID 64665808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).