N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide

C17H26N2O2 — CID 175311415

IUPACN-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide
SMILESCNC(=O)C1(Oc2ccccc2)CCN(CC(C)C)CC1
InChIInChI=1S/C17H26N2O2/c1-14(2)13-19-11-9-17(10-12-19,16(20)18-3)21-15-7-5-4-6-8-15/h4-8,14H,9-13H2,1-3H3,(H,18,20)
InChIKeyPIEIAFYGBIZBIX-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.30
Rot. Bonds5

About N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide

N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide (PubChem CID 175311415) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide
PubChem CID175311415
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide
SMILESCNC(=O)C1(Oc2ccccc2)CCN(CC(C)C)CC1
InChIInChI=1S/C17H26N2O2/c1-14(2)13-19-11-9-17(10-12-19,16(20)18-3)21-15-7-5-4-6-8-15/h4-8,14H,9-13H2,1-3H3,(H,18,20)
InChIKeyPIEIAFYGBIZBIX-UHFFFAOYSA-N
XLogP2.30
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide?
The IUPAC name of N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide (CID 175311415) is N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide.
What is the SMILES notation for N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide?
The canonical SMILES for N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide is CNC(=O)C1(Oc2ccccc2)CCN(CC(C)C)CC1.
What is the InChIKey of N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide?
The InChIKey is PIEIAFYGBIZBIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-14(2)13-19-11-9-17(10-12-19,16(20)18-3)21-15-7-5-4-6-8-15/h4-8,14H,9-13H2,1-3H3,(H,18,20).
What are the key properties of N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide?
N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide is sourced from PubChem (CID 175311415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).