N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine

C15H26N2O3 — CID 103180844

IUPACN-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine
SMILESCOCCCOCCOc1ccc(CNC(C)C)cn1
InChIInChI=1S/C15H26N2O3/c1-13(2)16-11-14-5-6-15(17-12-14)20-10-9-19-8-4-7-18-3/h5-6,12-13,16H,4,7-11H2,1-3H3
InChIKeyNPQXGBVJGDUYHU-UHFFFAOYSA-N
MW282.38 g/mol
LogP2.01
Rot. Bonds11

About N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine

N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine (PubChem CID 103180844) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine
PubChem CID103180844
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC NameN-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine
SMILESCOCCCOCCOc1ccc(CNC(C)C)cn1
InChIInChI=1S/C15H26N2O3/c1-13(2)16-11-14-5-6-15(17-12-14)20-10-9-19-8-4-7-18-3/h5-6,12-13,16H,4,7-11H2,1-3H3
InChIKeyNPQXGBVJGDUYHU-UHFFFAOYSA-N
XLogP2.01
TPSA52.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-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

N-[[6-[3-(2-methoxyethoxy)propoxy]-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 103405583
(2S,3R)-4-methoxy-N-[[6-(2-methoxyethoxy)-3-pyridinyl]methyl]-3-methylbutan-2-amine
CID 97341149
N-[[4-(3-methoxypropoxymethyl)phenyl]methyl]propan-2-amine
CID 62441668
N-[[6-(2-methylpropoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62289960
6-[2-(3-methoxypropoxy)ethoxy]pyridin-3-amine
CID 103176771
5-bromo-2-[2-(3-methoxypropoxy)ethoxy]pyridine
CID 103179380
N-[[3-chloro-4-[3-(2-methoxyethoxy)propoxy]phenyl]methyl]propan-2-amine
CID 103409034
N-[[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62297202
N-[[4-[2-(3-methoxypropoxy)ethylsulfanyl]phenyl]methyl]propan-2-amine
CID 103184284
N-[[3-fluoro-5-[2-(3-methoxypropoxy)ethoxy]phenyl]methyl]propan-2-amine
CID 103178014
N-[[3-methoxy-4-(3-methoxypropoxy)phenyl]methyl]propan-2-amine
CID 54935357
6-[2-(3-methoxypropoxy)ethoxy]pyridine-3-carbonitrile
CID 103177589

Frequently Asked Questions

What is the IUPAC name of N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine?
The IUPAC name of N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine (CID 103180844) is N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine is COCCCOCCOc1ccc(CNC(C)C)cn1.
What is the InChIKey of N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine?
The InChIKey is NPQXGBVJGDUYHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-13(2)16-11-14-5-6-15(17-12-14)20-10-9-19-8-4-7-18-3/h5-6,12-13,16H,4,7-11H2,1-3H3.
What are the key properties of N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine?
N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine has a molecular weight of 282.38 g/mol, XLogP of 2.01, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[2-(3-methoxypropoxy)ethoxy]-3-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 103180844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).