3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide

C15H30N2O2 — CID 55251825

IUPAC3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide
SMILESCC(CC(=O)NCCOC1CCNCC1)C(C)(C)C
InChIInChI=1S/C15H30N2O2/c1-12(15(2,3)4)11-14(18)17-9-10-19-13-5-7-16-8-6-13/h12-13,16H,5-11H2,1-4H3,(H,17,18)
InChIKeyAYKDAMZEUAHGHD-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.94
Rot. Bonds6

About 3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide

3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide (PubChem CID 55251825) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide.

Molecular Properties

Compound Name3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide
PubChem CID55251825
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide
SMILESCC(CC(=O)NCCOC1CCNCC1)C(C)(C)C
InChIInChI=1S/C15H30N2O2/c1-12(15(2,3)4)11-14(18)17-9-10-19-13-5-7-16-8-6-13/h12-13,16H,5-11H2,1-4H3,(H,17,18)
InChIKeyAYKDAMZEUAHGHD-UHFFFAOYSA-N
XLogP1.94
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate
CID 63871589
2-methyl-N-[2-(3-piperidin-4-yloxypropanoylamino)ethyl]propanamide
CID 63904487
2,2,2-trifluoro-N-(2-piperidin-4-yloxyethyl)acetamide
CID 63869260
3,4,4-trimethyl-N-(1-piperidin-4-ylethyl)pentanamide
CID 55260130
N-(2,3-dimethylbutyl)-3-piperidin-4-yloxypropanamide
CID 64599298
1,1-diethyl-3-(2-piperidin-4-yloxyethyl)urea
CID 79161980
1-butyl-3-(2-piperidin-4-yloxyethyl)urea
CID 55252329
3-amino-N-(2-cyclohexyloxyethyl)butanamide
CID 63828834
2-methoxy-N-(3-piperidin-4-yloxypropyl)acetamide
CID 63871786
(2S)-3,3-dimethyl-2-(3-piperidin-4-yloxypropanoylamino)butanoic acid
CID 63902962
2-amino-N-(2-cyclopentyloxyethyl)-3,3-dimethylbutanamide
CID 77009240
N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119669583

Frequently Asked Questions

What is the IUPAC name of 3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide?
The IUPAC name of 3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide (CID 55251825) is 3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide.
What is the SMILES notation for 3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide?
The canonical SMILES for 3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide is CC(CC(=O)NCCOC1CCNCC1)C(C)(C)C.
What is the InChIKey of 3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide?
The InChIKey is AYKDAMZEUAHGHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-12(15(2,3)4)11-14(18)17-9-10-19-13-5-7-16-8-6-13/h12-13,16H,5-11H2,1-4H3,(H,17,18).
What are the key properties of 3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide?
3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide has a molecular weight of 270.42 g/mol, XLogP of 1.94, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide is sourced from PubChem (CID 55251825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).