N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide

C22H30N2O4 — CID 112503668

IUPACN-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide
SMILESCCN(CC)C(CNC(=O)c1cc(OC)cc(OC)c1)c1ccc(OC)cc1
InChIInChI=1S/C22H30N2O4/c1-6-24(7-2)21(16-8-10-18(26-3)11-9-16)15-23-22(25)17-12-19(27-4)14-20(13-17)28-5/h8-14,21H,6-7,15H2,1-5H3,(H,23,25)
InChIKeyKDURWZJPQKTZPR-UHFFFAOYSA-N
MW386.49 g/mol
LogP3.53
Rot. Bonds10

About N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide

N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide (PubChem CID 112503668) has the molecular formula C22H30N2O4 and a molecular weight of 386.49 g/mol. Its IUPAC name is N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide
PubChem CID112503668
Molecular FormulaC22H30N2O4
Molecular Weight386.49 g/mol
Exact Mass386.22
IUPAC NameN-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide
SMILESCCN(CC)C(CNC(=O)c1cc(OC)cc(OC)c1)c1ccc(OC)cc1
InChIInChI=1S/C22H30N2O4/c1-6-24(7-2)21(16-8-10-18(26-3)11-9-16)15-23-22(25)17-12-19(27-4)14-20(13-17)28-5/h8-14,21H,6-7,15H2,1-5H3,(H,23,25)
InChIKeyKDURWZJPQKTZPR-UHFFFAOYSA-N
XLogP3.53
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.49
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxy-4-methylbenzamide
CID 43003305
N-[2-(diethylamino)-2-phenylethyl]-3,4,5-trimethoxybenzamide
CID 16549388
N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]-4-methoxybenzamide
CID 45001600
N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3-methylsulfonylpropanamide
CID 110621812
N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-3,4-dimethoxybenzamide
CID 3564631
N-[(2R)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-3,4-dimethylbenzamide
CID 7987402
N-[(2R)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-3,4-dimethoxybenzamide
CID 2129227
N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]-4-methoxybenzamide
CID 42279457
N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 51283227
N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide
CID 55350130
3,5-dimethoxy-N-[(2S)-2-[4-(2-methylpropyl)phenyl]propyl]benzamide
CID 102377978
3-amino-N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]benzamide
CID 119837714

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide?
The IUPAC name of N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide (CID 112503668) is N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide.
What is the SMILES notation for N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide?
The canonical SMILES for N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide is CCN(CC)C(CNC(=O)c1cc(OC)cc(OC)c1)c1ccc(OC)cc1.
What is the InChIKey of N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide?
The InChIKey is KDURWZJPQKTZPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O4/c1-6-24(7-2)21(16-8-10-18(26-3)11-9-16)15-23-22(25)17-12-19(27-4)14-20(13-17)28-5/h8-14,21H,6-7,15H2,1-5H3,(H,23,25).
What are the key properties of N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide?
N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide has a molecular weight of 386.49 g/mol, XLogP of 3.53, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide is sourced from PubChem (CID 112503668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).