N,N-diethyl-3-methoxypropan-1-amine;ethane

C10H25NO — CID 142226095

IUPACN,N-diethyl-3-methoxypropan-1-amine;ethane
SMILESCC.CCN(CC)CCCOC
InChIInChI=1S/C8H19NO.C2H6/c1-4-9(5-2)7-6-8-10-3;1-2/h4-8H2,1-3H3;1-2H3
InChIKeyZBBYVOVDMPASHK-UHFFFAOYSA-N
MW175.32 g/mol
LogP2.39
Rot. Bonds6

About N,N-diethyl-3-methoxypropan-1-amine;ethane

N,N-diethyl-3-methoxypropan-1-amine;ethane (PubChem CID 142226095) has the molecular formula C10H25NO and a molecular weight of 175.32 g/mol. Its IUPAC name is N,N-diethyl-3-methoxypropan-1-amine;ethane.

Molecular Properties

Compound NameN,N-diethyl-3-methoxypropan-1-amine;ethane
PubChem CID142226095
Molecular FormulaC10H25NO
Molecular Weight175.32 g/mol
Exact Mass175.19
IUPAC NameN,N-diethyl-3-methoxypropan-1-amine;ethane
SMILESCC.CCN(CC)CCCOC
InChIInChI=1S/C8H19NO.C2H6/c1-4-9(5-2)7-6-8-10-3;1-2/h4-8H2,1-3H3;1-2H3
InChIKeyZBBYVOVDMPASHK-UHFFFAOYSA-N
XLogP2.39
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.32
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N,N-diethyl-3-methoxypropan-1-amine;ethane 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

N-ethyl-3-methoxy-N-(2-methoxyethyl)propan-1-amine
CID 143003406
N-ethyl-3-methoxy-N-(3-propan-2-yloxypropyl)propan-1-amine
CID 156884772
N-(3-methoxypropyl)-N-propylbutan-1-amine
CID 148527090
ethane;N-ethyl-N-(2-methoxyethyl)pentan-1-amine
CID 176555082
3-bromo-N-ethyl-N-[2-(3-methoxypropoxy)ethyl]propan-1-amine
CID 103184049
N'-ethyl-N'-(2-methoxyethyl)propane-1,3-diamine
CID 43137192
N-ethyl-N-(2-methoxyethyl)decan-1-amine
CID 150451072
(5R)-N,N,5-triethyl-7-methoxyheptan-1-amine
CID 118890299
N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine
CID 103178048
4-[ethyl(2-methoxyethyl)amino]butan-1-ol;yttrium
CID 156869165
N'-ethyl-N'-(2-methoxyethyl)hexane-1,6-diamine
CID 61447800
5-chloro-N-ethyl-N-(2-methoxyethyl)pentan-1-amine
CID 61446826

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-methoxypropan-1-amine;ethane?
The IUPAC name of N,N-diethyl-3-methoxypropan-1-amine;ethane (CID 142226095) is N,N-diethyl-3-methoxypropan-1-amine;ethane.
What is the SMILES notation for N,N-diethyl-3-methoxypropan-1-amine;ethane?
The canonical SMILES for N,N-diethyl-3-methoxypropan-1-amine;ethane is CC.CCN(CC)CCCOC.
What is the InChIKey of N,N-diethyl-3-methoxypropan-1-amine;ethane?
The InChIKey is ZBBYVOVDMPASHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO.C2H6/c1-4-9(5-2)7-6-8-10-3;1-2/h4-8H2,1-3H3;1-2H3.
What are the key properties of N,N-diethyl-3-methoxypropan-1-amine;ethane?
N,N-diethyl-3-methoxypropan-1-amine;ethane has a molecular weight of 175.32 g/mol, XLogP of 2.39, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-methoxypropan-1-amine;ethane is sourced from PubChem (CID 142226095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).