N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine

C12H26N2O — CID 58365048

IUPACN-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine
SMILESCOCCN1CCC(NC(C)(C)C)CC1
InChIInChI=1S/C12H26N2O/c1-12(2,3)13-11-5-7-14(8-6-11)9-10-15-4/h11,13H,5-10H2,1-4H3
InChIKeyQZZWUVWMVRBQAM-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.49
Rot. Bonds4

About N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine

N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine (PubChem CID 58365048) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine
PubChem CID58365048
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine
SMILESCOCCN1CCC(NC(C)(C)C)CC1
InChIInChI=1S/C12H26N2O/c1-12(2,3)13-11-5-7-14(8-6-11)9-10-15-4/h11,13H,5-10H2,1-4H3
InChIKeyQZZWUVWMVRBQAM-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine?
The IUPAC name of N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine (CID 58365048) is N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine.
What is the SMILES notation for N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine?
The canonical SMILES for N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine is COCCN1CCC(NC(C)(C)C)CC1.
What is the InChIKey of N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine?
The InChIKey is QZZWUVWMVRBQAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-12(2,3)13-11-5-7-14(8-6-11)9-10-15-4/h11,13H,5-10H2,1-4H3.
What are the key properties of N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine?
N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine has a molecular weight of 214.35 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine is sourced from PubChem (CID 58365048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).