4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide

C19H23N3O5 — CID 119527473

IUPAC4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide
SMILESCOc1cc(C(=O)NCC(N)c2ccccc2)cc(OC)c1OCC(N)=O
InChIInChI=1S/C19H23N3O5/c1-25-15-8-13(9-16(26-2)18(15)27-11-17(21)23)19(24)22-10-14(20)12-6-4-3-5-7-12/h3-9,14H,10-11,20H2,1-2H3,(H2,21,23)(H,22,24)
InChIKeyMOEIFXFTFRCUJZ-UHFFFAOYSA-N
MW373.41 g/mol
LogP1.00
Rot. Bonds9

About 4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide

4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide (PubChem CID 119527473) has the molecular formula C19H23N3O5 and a molecular weight of 373.41 g/mol. Its IUPAC name is 4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide.

Molecular Properties

Compound Name4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide
PubChem CID119527473
Molecular FormulaC19H23N3O5
Molecular Weight373.41 g/mol
Exact Mass373.16
IUPAC Name4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide
SMILESCOc1cc(C(=O)NCC(N)c2ccccc2)cc(OC)c1OCC(N)=O
InChIInChI=1S/C19H23N3O5/c1-25-15-8-13(9-16(26-2)18(15)27-11-17(21)23)19(24)22-10-14(20)12-6-4-3-5-7-12/h3-9,14H,10-11,20H2,1-2H3,(H2,21,23)(H,22,24)
InChIKeyMOEIFXFTFRCUJZ-UHFFFAOYSA-N
XLogP1.00
TPSA125.90 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 51.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

3-acetamido-N-(2-amino-2-phenylethyl)-4,5-dimethoxybenzamide;hydrochloride
CID 119527646
N-(2-amino-2-phenylethyl)-3-bromo-4-ethoxy-5-methoxybenzamide
CID 119527394
N-(2-amino-2-phenylethyl)-3,4,5-triethoxybenzamide
CID 119527990
4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide
CID 55415145
4-(2-amino-2-oxoethoxy)-N-[(R)-(4-bromophenyl)-phenylmethyl]-3,5-dimethoxybenzamide
CID 52909496
4-(2-amino-2-oxoethoxy)-N-[(4-fluorophenyl)-phenylmethyl]-3,5-dimethoxybenzamide
CID 55583447
N-[2-(diethylamino)-2-phenylethyl]-3,4,5-trimethoxybenzamide
CID 16549388
2-[[4-(2-amino-2-oxoethoxy)-3,5-dimethoxybenzoyl]amino]-3-methylbutanoic acid
CID 119169977
N-(2-amino-2-phenylethyl)-3,4-dimethylbenzamide
CID 63120465
3-chloro-4,5-dimethoxy-N-[(2R)-2-phenylpropyl]benzamide
CID 9301624
N-(2-amino-2-phenylethyl)-4-butoxy-3-ethoxybenzamide
CID 119528578
N-(2-amino-2-phenylethyl)-4-butoxy-3-ethoxybenzamide;hydrochloride
CID 119528577

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide?
The IUPAC name of 4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide (CID 119527473) is 4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide.
What is the SMILES notation for 4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide?
The canonical SMILES for 4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide is COc1cc(C(=O)NCC(N)c2ccccc2)cc(OC)c1OCC(N)=O.
What is the InChIKey of 4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide?
The InChIKey is MOEIFXFTFRCUJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O5/c1-25-15-8-13(9-16(26-2)18(15)27-11-17(21)23)19(24)22-10-14(20)12-6-4-3-5-7-12/h3-9,14H,10-11,20H2,1-2H3,(H2,21,23)(H,22,24).
What are the key properties of 4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide?
4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide has a molecular weight of 373.41 g/mol, XLogP of 1.00, 9 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide is sourced from PubChem (CID 119527473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).