N,N'-bis(2-ethoxyphenyl)butanediamide

C20H24N2O4 — CID 1294108

IUPACN,N'-bis(2-ethoxyphenyl)butanediamide
SMILESCCOc1ccccc1NC(=O)CCC(=O)Nc1ccccc1OCC
InChIInChI=1S/C20H24N2O4/c1-3-25-17-11-7-5-9-15(17)21-19(23)13-14-20(24)22-16-10-6-8-12-18(16)26-4-2/h5-12H,3-4,13-14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyZGPWFGYWNROSFL-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.84
Rot. Bonds9

About N,N'-bis(2-ethoxyphenyl)butanediamide

N,N'-bis(2-ethoxyphenyl)butanediamide (PubChem CID 1294108) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N,N'-bis(2-ethoxyphenyl)butanediamide.

Molecular Properties

Compound NameN,N'-bis(2-ethoxyphenyl)butanediamide
PubChem CID1294108
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN,N'-bis(2-ethoxyphenyl)butanediamide
SMILESCCOc1ccccc1NC(=O)CCC(=O)Nc1ccccc1OCC
InChIInChI=1S/C20H24N2O4/c1-3-25-17-11-7-5-9-15(17)21-19(23)13-14-20(24)22-16-10-6-8-12-18(16)26-4-2/h5-12H,3-4,13-14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyZGPWFGYWNROSFL-UHFFFAOYSA-N
XLogP3.84
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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N-(3-amino-4-ethoxyphenyl)acetamide
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N-(4-Phenoxyphenyl)acetamide
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2-Ethoxy-2'-ethyloxanilide
CID 90303
o-Ethoxyacetanilide
CID 11383
2H-1,4-benzoxazin-3(4H)-one
CID 72757
2'-(Trifluoromethoxy)acetanilide
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[4-[(2-Ethoxyphenyl)carbamoylamino]phenyl] sulfamate
CID 70696644
Acetamide, N-(4-(3-(4-(2-methoxyphenyl)-1-piperazinyl)propoxy)phenyl)-
CID 55421

Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2-ethoxyphenyl)butanediamide?
The IUPAC name of N,N'-bis(2-ethoxyphenyl)butanediamide (CID 1294108) is N,N'-bis(2-ethoxyphenyl)butanediamide.
What is the SMILES notation for N,N'-bis(2-ethoxyphenyl)butanediamide?
The canonical SMILES for N,N'-bis(2-ethoxyphenyl)butanediamide is CCOc1ccccc1NC(=O)CCC(=O)Nc1ccccc1OCC.
What is the InChIKey of N,N'-bis(2-ethoxyphenyl)butanediamide?
The InChIKey is ZGPWFGYWNROSFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-3-25-17-11-7-5-9-15(17)21-19(23)13-14-20(24)22-16-10-6-8-12-18(16)26-4-2/h5-12H,3-4,13-14H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N,N'-bis(2-ethoxyphenyl)butanediamide?
N,N'-bis(2-ethoxyphenyl)butanediamide has a molecular weight of 356.42 g/mol, XLogP of 3.84, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2-ethoxyphenyl)butanediamide is sourced from PubChem (CID 1294108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).