N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine

C17H36N2O — CID 106617543

IUPACN-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine
SMILESCCCCCCCCCN(CCOC)CC1CCCN1
InChIInChI=1S/C17H36N2O/c1-3-4-5-6-7-8-9-13-19(14-15-20-2)16-17-11-10-12-18-17/h17-18H,3-16H2,1-2H3
InChIKeyQDLNJRNDXLTNAU-UHFFFAOYSA-N
MW284.49 g/mol
LogP3.44
Rot. Bonds13

About N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine

N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine (PubChem CID 106617543) has the molecular formula C17H36N2O and a molecular weight of 284.49 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine
PubChem CID106617543
Molecular FormulaC17H36N2O
Molecular Weight284.49 g/mol
Exact Mass284.28
IUPAC NameN-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine
SMILESCCCCCCCCCN(CCOC)CC1CCCN1
InChIInChI=1S/C17H36N2O/c1-3-4-5-6-7-8-9-13-19(14-15-20-2)16-17-11-10-12-18-17/h17-18H,3-16H2,1-2H3
InChIKeyQDLNJRNDXLTNAU-UHFFFAOYSA-N
XLogP3.44
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.49
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-methoxy-N-(2-methoxyethyl)-N-[[(2R)-pyrrolidin-2-yl]methyl]propan-1-amine
CID 102819399
5-fluoro-N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)pentan-1-amine
CID 114280319
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-N-(pyrrolidin-2-ylmethyl)butan-1-amine
CID 106616773
N-propyl-N-(pyrrolidin-2-ylmethyl)pentan-1-amine
CID 106603768
N,N-diethyl-N'-(2-methoxyethyl)-N'-(pyrrolidin-2-ylmethyl)ethane-1,2-diamine
CID 106617646
N-(azepan-2-ylmethyl)-2-methoxy-N-(2-methoxyethyl)ethanamine
CID 64569967
N'-(2-methoxyethyl)-N,N-dimethyl-N'-(pyrrolidin-2-ylmethyl)ethane-1,2-diamine
CID 106617601
N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)octan-1-amine
CID 106605331
6-[2-methoxyethyl(pyrrolidin-2-ylmethyl)amino]-2,2-dimethylhexanenitrile
CID 106713476
N-butyl-N-[[(2R)-piperidin-2-yl]methyl]butan-1-amine
CID 28983352
N-[2-(3-methoxypropoxy)ethyl]-N-(piperidin-2-ylmethyl)propan-1-amine
CID 106635937
N-(2-methoxyethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-1-amine
CID 106606339

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine?
The IUPAC name of N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine (CID 106617543) is N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine is CCCCCCCCCN(CCOC)CC1CCCN1.
What is the InChIKey of N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine?
The InChIKey is QDLNJRNDXLTNAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O/c1-3-4-5-6-7-8-9-13-19(14-15-20-2)16-17-11-10-12-18-17/h17-18H,3-16H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine?
N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine has a molecular weight of 284.49 g/mol, XLogP of 3.44, 13 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)nonan-1-amine is sourced from PubChem (CID 106617543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).