N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide

C16H24N2O2 — CID 114423253

IUPACN-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide
SMILESCCOc1cc(C)ccc1NC(=O)C1CC(C)CCN1
InChIInChI=1S/C16H24N2O2/c1-4-20-15-10-11(2)5-6-13(15)18-16(19)14-9-12(3)7-8-17-14/h5-6,10,12,14,17H,4,7-9H2,1-3H3,(H,18,19)
InChIKeyPWSFGOONFFSKJD-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.72
Rot. Bonds4

About N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide

N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide (PubChem CID 114423253) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide
PubChem CID114423253
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide
SMILESCCOc1cc(C)ccc1NC(=O)C1CC(C)CCN1
InChIInChI=1S/C16H24N2O2/c1-4-20-15-10-11(2)5-6-13(15)18-16(19)14-9-12(3)7-8-17-14/h5-6,10,12,14,17H,4,7-9H2,1-3H3,(H,18,19)
InChIKeyPWSFGOONFFSKJD-UHFFFAOYSA-N
XLogP2.72
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(2-ethoxy-4-methylphenyl)pyrrolidine-2-carboxamide
CID 93360332
N-(2-ethoxy-4-methylphenyl)thiomorpholine-3-carboxamide
CID 82908618
N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide
CID 114428305
N-(4-methyl-2-propoxyphenyl)azepane-2-carboxamide
CID 64561866
2-[(2-ethoxy-4-methylphenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978084
3-methyl-N-(4-methyl-2-propoxyphenyl)pyrrolidine-2-carboxamide
CID 102778369
N-(4-iodo-2-methylphenyl)-4-methylpiperidine-2-carboxamide
CID 114423070
methyl 3-methyl-4-[(4-methylpiperidine-2-carbonyl)amino]benzoate
CID 114423164
(2S)-N-(2-methoxy-4-methylphenyl)pyrrolidine-2-carboxamide
CID 61178330
5-[(2-ethoxy-4-methylphenyl)carbamoyl]oxolane-2-carboxylic acid
CID 102687855
N-(2-ethoxy-4-fluorophenyl)-2-methylpyrrolidine-3-carboxamide
CID 79388668
5-methoxy-2-[(4-methylpiperidine-2-carbonyl)amino]benzoic acid
CID 114424357

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide?
The IUPAC name of N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide (CID 114423253) is N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide?
The canonical SMILES for N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide is CCOc1cc(C)ccc1NC(=O)C1CC(C)CCN1.
What is the InChIKey of N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide?
The InChIKey is PWSFGOONFFSKJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-20-15-10-11(2)5-6-13(15)18-16(19)14-9-12(3)7-8-17-14/h5-6,10,12,14,17H,4,7-9H2,1-3H3,(H,18,19).
What are the key properties of N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide?
N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.72, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide is sourced from PubChem (CID 114423253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).