6-(3-methoxypyrrolidin-1-yl)hexan-2-amine

C11H24N2O — CID 103532346

IUPAC6-(3-methoxypyrrolidin-1-yl)hexan-2-amine
SMILESCOC1CCN(CCCCC(C)N)C1
InChIInChI=1S/C11H24N2O/c1-10(12)5-3-4-7-13-8-6-11(9-13)14-2/h10-11H,3-9,12H2,1-2H3
InChIKeyUPMGFGQZIDGUGW-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.22
Rot. Bonds6

About 6-(3-methoxypyrrolidin-1-yl)hexan-2-amine

6-(3-methoxypyrrolidin-1-yl)hexan-2-amine (PubChem CID 103532346) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 6-(3-methoxypyrrolidin-1-yl)hexan-2-amine.

Molecular Properties

Compound Name6-(3-methoxypyrrolidin-1-yl)hexan-2-amine
PubChem CID103532346
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name6-(3-methoxypyrrolidin-1-yl)hexan-2-amine
SMILESCOC1CCN(CCCCC(C)N)C1
InChIInChI=1S/C11H24N2O/c1-10(12)5-3-4-7-13-8-6-11(9-13)14-2/h10-11H,3-9,12H2,1-2H3
InChIKeyUPMGFGQZIDGUGW-UHFFFAOYSA-N
XLogP1.22
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.22
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

5-(3-methoxypyrrolidin-1-yl)pentan-2-amine
CID 103532229
4-(3-methoxypyrrolidin-1-yl)butan-1-amine
CID 69155262
6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-2-amine
CID 64570092
6-(3-methoxypyrrolidin-1-yl)hexane-1-thiol
CID 103541634
2-amino-4-(3-methoxypyrrolidin-1-yl)butanoic acid
CID 103537951
4-(3-methoxypyrrolidin-1-yl)butanoic acid
CID 103535134
5-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine
CID 64570689
methyl 4-(3-methoxypyrrolidin-1-yl)butanoate
CID 103535204
N-[6-(3-methoxypyrrolidin-1-yl)hexyl]cyclopropanamine
CID 103539769
5-(3-methoxypyrrolidin-1-yl)pentanehydrazide
CID 103540509
2-methoxy-4-(3-methoxypyrrolidin-1-yl)butan-1-amine
CID 103534710
5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)pentan-2-amine
CID 79175495

Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxypyrrolidin-1-yl)hexan-2-amine?
The IUPAC name of 6-(3-methoxypyrrolidin-1-yl)hexan-2-amine (CID 103532346) is 6-(3-methoxypyrrolidin-1-yl)hexan-2-amine.
What is the SMILES notation for 6-(3-methoxypyrrolidin-1-yl)hexan-2-amine?
The canonical SMILES for 6-(3-methoxypyrrolidin-1-yl)hexan-2-amine is COC1CCN(CCCCC(C)N)C1.
What is the InChIKey of 6-(3-methoxypyrrolidin-1-yl)hexan-2-amine?
The InChIKey is UPMGFGQZIDGUGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-10(12)5-3-4-7-13-8-6-11(9-13)14-2/h10-11H,3-9,12H2,1-2H3.
What are the key properties of 6-(3-methoxypyrrolidin-1-yl)hexan-2-amine?
6-(3-methoxypyrrolidin-1-yl)hexan-2-amine has a molecular weight of 200.33 g/mol, XLogP of 1.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxypyrrolidin-1-yl)hexan-2-amine is sourced from PubChem (CID 103532346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).