N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide

C16H23FN2O2 — CID 114428305

IUPACN-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide
SMILESCCOc1cc(F)ccc1NC(=O)C1CC(CC)CCN1
InChIInChI=1S/C16H23FN2O2/c1-3-11-7-8-18-14(9-11)16(20)19-13-6-5-12(17)10-15(13)21-4-2/h5-6,10-11,14,18H,3-4,7-9H2,1-2H3,(H,19,20)
InChIKeyPPISOVBSZGJIAK-UHFFFAOYSA-N
MW294.37 g/mol
LogP2.94
Rot. Bonds5

About N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide

N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide (PubChem CID 114428305) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide
PubChem CID114428305
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC NameN-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide
SMILESCCOc1cc(F)ccc1NC(=O)C1CC(CC)CCN1
InChIInChI=1S/C16H23FN2O2/c1-3-11-7-8-18-14(9-11)16(20)19-13-6-5-12(17)10-15(13)21-4-2/h5-6,10-11,14,18H,3-4,7-9H2,1-2H3,(H,19,20)
InChIKeyPPISOVBSZGJIAK-UHFFFAOYSA-N
XLogP2.94
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethoxy-4-fluorophenyl)-2-methylpyrrolidine-3-carboxamide
CID 79388668
4-ethyl-N-(2-methoxyphenyl)piperidine-2-carboxamide
CID 114427816
4-ethyl-N-(2-propoxyphenyl)piperidine-2-carboxamide
CID 114428199
4-ethyl-N-(5-fluoro-2-pyridinyl)piperidine-2-carboxamide
CID 114429180
N-(2-ethoxy-4-methylphenyl)-4-methylpiperidine-2-carboxamide
CID 114423253
N-(2-ethoxy-4-fluorophenyl)-5-oxopiperazine-2-carboxamide
CID 107434659
(3R)-N-(2-ethoxy-4-fluorophenyl)piperidine-3-carboxamide
CID 81124349
3-[(4-ethylpiperidine-2-carbonyl)amino]-4-fluorobenzoic acid
CID 114428301
N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide
CID 114427861
4-ethyl-N-(3-fluoro-2-methylphenyl)piperidine-2-carboxamide
CID 114428836
4-ethyl-N-(3-fluoro-4-methoxyphenyl)piperidine-2-carboxamide
CID 114428053
N-(2,6-difluorophenyl)-4-ethylpiperidine-2-carboxamide
CID 114428002

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide?
The IUPAC name of N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide (CID 114428305) is N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide?
The canonical SMILES for N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide is CCOc1cc(F)ccc1NC(=O)C1CC(CC)CCN1.
What is the InChIKey of N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide?
The InChIKey is PPISOVBSZGJIAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-3-11-7-8-18-14(9-11)16(20)19-13-6-5-12(17)10-15(13)21-4-2/h5-6,10-11,14,18H,3-4,7-9H2,1-2H3,(H,19,20).
What are the key properties of N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide?
N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide has a molecular weight of 294.37 g/mol, XLogP of 2.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide is sourced from PubChem (CID 114428305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).