N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine

C12H26N2O — CID 55210208

IUPACN-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCOCCN1CCCC1CNC(C)(C)C
InChIInChI=1S/C12H26N2O/c1-12(2,3)13-10-11-6-5-7-14(11)8-9-15-4/h11,13H,5-10H2,1-4H3
InChIKeyPVHBHTUPHNIKHW-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.49
Rot. Bonds5

About N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine

N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 55210208) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID55210208
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCOCCN1CCCC1CNC(C)(C)C
InChIInChI=1S/C12H26N2O/c1-12(2,3)13-10-11-6-5-7-14(11)8-9-15-4/h11,13H,5-10H2,1-4H3
InChIKeyPVHBHTUPHNIKHW-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine (CID 55210208) is N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine is COCCN1CCCC1CNC(C)(C)C.
What is the InChIKey of N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is PVHBHTUPHNIKHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-12(2,3)13-10-11-6-5-7-14(11)8-9-15-4/h11,13H,5-10H2,1-4H3.
What are the key properties of N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine?
N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 214.35 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 55210208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).