N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide

C16H24N2O3 — CID 114427861

IUPACN-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)Nc2cc(OC)ccc2OC)C1
InChIInChI=1S/C16H24N2O3/c1-4-11-7-8-17-14(9-11)16(19)18-13-10-12(20-2)5-6-15(13)21-3/h5-6,10-11,14,17H,4,7-9H2,1-3H3,(H,18,19)
InChIKeyVQKPXVAGSUAUTH-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.42
Rot. Bonds5

About N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide

N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide (PubChem CID 114427861) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide
PubChem CID114427861
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)Nc2cc(OC)ccc2OC)C1
InChIInChI=1S/C16H24N2O3/c1-4-11-7-8-17-14(9-11)16(19)18-13-10-12(20-2)5-6-15(13)21-3/h5-6,10-11,14,17H,4,7-9H2,1-3H3,(H,18,19)
InChIKeyVQKPXVAGSUAUTH-UHFFFAOYSA-N
XLogP2.42
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chloro-5-methoxyphenyl)-4-ethylpiperidine-2-carboxamide
CID 114428835
4-ethyl-N-(2-methoxyphenyl)piperidine-2-carboxamide
CID 114427816
4-ethyl-N-(3-fluoro-4-methoxyphenyl)piperidine-2-carboxamide
CID 114428053
N-(2,5-dimethoxyphenyl)-3-methylpyrrolidine-2-carboxamide
CID 102776855
N-(2-ethoxy-4-fluorophenyl)-4-ethylpiperidine-2-carboxamide
CID 114428305
4-ethyl-N-(2-propoxyphenyl)piperidine-2-carboxamide
CID 114428199
4-butyl-N-(2,5-dimethoxyphenyl)cyclohexane-1-carboxamide
CID 19206893
(3R)-N-(2,5-dimethoxyphenyl)-5-oxo-1,4-thiazepane-3-carboxamide
CID 100825016
(2S,4S)-N-(2-butoxy-5-methoxyphenyl)-2-methylpiperidine-4-carboxamide
CID 120621294
N-(2,5-dimethoxyphenyl)-3-piperidin-4-ylpropanamide
CID 62210492
4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide
CID 104921952
3-[(4-ethylpiperidine-2-carbonyl)amino]-4-fluorobenzoic acid
CID 114428301

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide (CID 114427861) is N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide is CCC1CCNC(C(=O)Nc2cc(OC)ccc2OC)C1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide?
The InChIKey is VQKPXVAGSUAUTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-4-11-7-8-17-14(9-11)16(19)18-13-10-12(20-2)5-6-15(13)21-3/h5-6,10-11,14,17H,4,7-9H2,1-3H3,(H,18,19).
What are the key properties of N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide?
N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 2.42, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-4-ethylpiperidine-2-carboxamide is sourced from PubChem (CID 114427861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).