4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide

C12H24N2O2 — CID 104578083

IUPAC4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide
SMILESCC1CCN(C(=O)NCCOC(C)C)CC1
InChIInChI=1S/C12H24N2O2/c1-10(2)16-9-6-13-12(15)14-7-4-11(3)5-8-14/h10-11H,4-9H2,1-3H3,(H,13,15)
InChIKeyHBVGGTKPIFJGJQ-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.85
Rot. Bonds4

About 4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide

4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide (PubChem CID 104578083) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide
PubChem CID104578083
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide
SMILESCC1CCN(C(=O)NCCOC(C)C)CC1
InChIInChI=1S/C12H24N2O2/c1-10(2)16-9-6-13-12(15)14-7-4-11(3)5-8-14/h10-11H,4-9H2,1-3H3,(H,13,15)
InChIKeyHBVGGTKPIFJGJQ-UHFFFAOYSA-N
XLogP1.85
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2-propan-2-yloxyethylcarbamoyl)piperidine-4-carboxylic acid
CID 113450641
4-methyl-N-(3-methylbutyl)piperidine-1-carboxamide
CID 51712124
propan-2-yl 3-[(4-methylpiperidine-1-carbonyl)amino]propanoate
CID 52539083
N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide
CID 79160258
2-[2-[(4-methylpiperidine-1-carbonyl)amino]ethoxy]acetic acid
CID 79457260
N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide
CID 113233568
4-methyl-N-propylpiperidine-1-carboxamide
CID 19169940
N-[(3R)-3-fluorobutyl]-4-methylpiperidine-1-carboxamide
CID 129348452
3-methyl-N-(3-propan-2-yloxypropyl)piperidine-1-carboxamide
CID 86811915
3-[1-(2-propan-2-yloxyethylcarbamoyl)pyrrolidin-3-yl]propanoic acid
CID 104763771
N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpiperidine-1-carboxamide
CID 115583128
N-(2-ethoxypropyl)-4-methylpiperidine-1-carboxamide
CID 115667465

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide?
The IUPAC name of 4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide (CID 104578083) is 4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide?
The canonical SMILES for 4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide is CC1CCN(C(=O)NCCOC(C)C)CC1.
What is the InChIKey of 4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide?
The InChIKey is HBVGGTKPIFJGJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-10(2)16-9-6-13-12(15)14-7-4-11(3)5-8-14/h10-11H,4-9H2,1-3H3,(H,13,15).
What are the key properties of 4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide?
4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide has a molecular weight of 228.34 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide is sourced from PubChem (CID 104578083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).