N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine

C10H22N2O — CID 106455097

IUPACN-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine
SMILESCCCOCCN1CCC(NC)C1
InChIInChI=1S/C10H22N2O/c1-3-7-13-8-6-12-5-4-10(9-12)11-2/h10-11H,3-9H2,1-2H3
InChIKeyGHEXFYVRTRTKLT-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.71
Rot. Bonds6

About N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine

N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine (PubChem CID 106455097) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine
PubChem CID106455097
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine
SMILESCCCOCCN1CCC(NC)C1
InChIInChI=1S/C10H22N2O/c1-3-7-13-8-6-12-5-4-10(9-12)11-2/h10-11H,3-9H2,1-2H3
InChIKeyGHEXFYVRTRTKLT-UHFFFAOYSA-N
XLogP0.71
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.71
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

1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-N-methylpiperidin-4-amine
CID 104560353
1-(3-methoxypropyl)-N-methylpyrrolidin-3-amine
CID 43315586
1-(2-ethoxyethyl)-N-propylpyrrolidin-3-amine
CID 43591122
4-bromo-3-methyl-1-(2-propoxyethyl)piperidine
CID 106457883
2-[1-(2-propoxyethyl)pyrrolidin-3-yl]ethanol
CID 106456274
1-butyl-N-methylpiperidin-3-amine
CID 62534430
1-(3-ethoxypropyl)-N-methylpiperidin-4-amine
CID 43315421
N-[[1-(2-propoxyethyl)piperidin-4-yl]methyl]ethanamine
CID 106453503
1-[2-(cyclopropylmethoxy)ethyl]-N-methylpiperidin-4-amine
CID 103815473
N-methyl-2-[4-(2-propoxyethyl)piperazin-1-yl]ethanamine
CID 166151976
ethane;N-methyl-1-(3-methylbutyl)pyrrolidin-3-amine
CID 166168128
N-methyl-1-[3-[methyl(propan-2-yl)amino]propyl]pyrrolidin-3-amine
CID 106039993

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine?
The IUPAC name of N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine (CID 106455097) is N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine.
What is the SMILES notation for N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine?
The canonical SMILES for N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine is CCCOCCN1CCC(NC)C1.
What is the InChIKey of N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine?
The InChIKey is GHEXFYVRTRTKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-3-7-13-8-6-12-5-4-10(9-12)11-2/h10-11H,3-9H2,1-2H3.
What are the key properties of N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine?
N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine has a molecular weight of 186.30 g/mol, XLogP of 0.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine is sourced from PubChem (CID 106455097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).