N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide

C15H23N3O3 — CID 108867993

IUPACN-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide
SMILESCCN1CCN(C(=O)Nc2c(OC)cccc2OC)CC1
InChIInChI=1S/C15H23N3O3/c1-4-17-8-10-18(11-9-17)15(19)16-14-12(20-2)6-5-7-13(14)21-3/h5-7H,4,8-11H2,1-3H3,(H,16,19)
InChIKeyFDXXLTGTLNDGOH-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.87
Rot. Bonds4

About N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide

N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide (PubChem CID 108867993) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide
PubChem CID108867993
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC NameN-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide
SMILESCCN1CCN(C(=O)Nc2c(OC)cccc2OC)CC1
InChIInChI=1S/C15H23N3O3/c1-4-17-8-10-18(11-9-17)15(19)16-14-12(20-2)6-5-7-13(14)21-3/h5-7H,4,8-11H2,1-3H3,(H,16,19)
InChIKeyFDXXLTGTLNDGOH-UHFFFAOYSA-N
XLogP1.87
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-dimethoxyphenyl)-4-(2-hydroxyethyl)piperazine-1-carboxamide
CID 108867927
N-(2,6-dimethoxyphenyl)-2-(4-ethylpiperazin-1-yl)acetamide
CID 1439205
2-[(4-ethylpiperazine-1-carbonyl)amino]-3-methylbenzoic acid
CID 61190598
N-(3-chloro-4-methoxyphenyl)-4-ethylpiperazine-1-carboxamide
CID 108988526
4-ethyl-N-[(1S)-1-(2-fluoro-6-methoxyphenyl)ethyl]piperazine-1-carboxamide
CID 95968299
N-[2-(aminomethyl)-6-methoxyphenyl]azepane-1-carboxamide
CID 107467309
N-[4-[[4-(aziridine-1-carbonylamino)-3,5-dimethoxyphenyl]methyl]-2,6-dimethoxyphenyl]aziridine-1-carboxamide
CID 19762223
1-(4-ethylpiperazin-1-yl)-2-(2-methoxyphenyl)ethane-1,2-dione
CID 94285171
4-(2-hydroxyethyl)-N-(2-methoxyphenyl)piperazine-1-carboxamide
CID 43393054
N-(2-cyano-6-methoxyphenyl)azepane-1-carboxamide
CID 107467260
N-(2,6-dimethylphenyl)-4-(2-methoxyethyl)piperazine-1-carboxamide
CID 113104947
(2R)-1-(4-ethylpiperazin-1-yl)-2-(2-methoxyphenoxy)propan-1-one
CID 9181761

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide?
The IUPAC name of N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide (CID 108867993) is N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide.
What is the SMILES notation for N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide?
The canonical SMILES for N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide is CCN1CCN(C(=O)Nc2c(OC)cccc2OC)CC1.
What is the InChIKey of N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide?
The InChIKey is FDXXLTGTLNDGOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-4-17-8-10-18(11-9-17)15(19)16-14-12(20-2)6-5-7-13(14)21-3/h5-7H,4,8-11H2,1-3H3,(H,16,19).
What are the key properties of N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide?
N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethoxyphenyl)-4-ethylpiperazine-1-carboxamide is sourced from PubChem (CID 108867993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).