(2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide

C20H24N2O4 — CID 70327472

IUPAC(2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide
SMILESC=C(c1cc(OC)cc(OC)c1)c1ccc(OC)c(NC(=O)[C@@H](C)N)c1
InChIInChI=1S/C20H24N2O4/c1-12(15-8-16(24-3)11-17(9-15)25-4)14-6-7-19(26-5)18(10-14)22-20(23)13(2)21/h6-11,13H,1,21H2,2-5H3,(H,22,23)/t13-/m1/s1
InChIKeyWWTCDIZPJPPKET-CYBMUJFWSA-N
MW356.42 g/mol
LogP3.06
Rot. Bonds7

About (2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide

(2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide (PubChem CID 70327472) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is (2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide
PubChem CID70327472
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name(2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide
SMILESC=C(c1cc(OC)cc(OC)c1)c1ccc(OC)c(NC(=O)[C@@H](C)N)c1
InChIInChI=1S/C20H24N2O4/c1-12(15-8-16(24-3)11-17(9-15)25-4)14-6-7-19(26-5)18(10-14)22-20(23)13(2)21/h6-11,13H,1,21H2,2-5H3,(H,22,23)/t13-/m1/s1
InChIKeyWWTCDIZPJPPKET-CYBMUJFWSA-N
XLogP3.06
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide
CID 22690513
(2S)-2-amino-N-(5-chloro-2-methoxyphenyl)propanamide;hydrochloride
CID 119262144
(2S)-2-amino-N-(5-bromo-2-methoxyphenyl)propanamide;hydrochloride
CID 119292528
2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide
CID 43424856
N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride
CID 119266368
4-[[(2R)-2-aminopropanoyl]amino]-3-methoxybenzoic acid
CID 167188995
4-methoxy-3-(2-methylpropanoylamino)benzoic acid
CID 63742748
3-[(2-amino-3,3-dimethylbutanoyl)amino]-4-methoxybenzamide
CID 76887811
3-[[(2S)-2-amino-3-methylpentanoyl]amino]-4-methoxybenzoic acid
CID 63744628
3-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-methoxybenzoic acid
CID 63742251
3-[[(2S)-2-amino-4-methylpentanoyl]amino]-4-methoxybenzamide
CID 61179555
2-amino-N-(2,5-dimethoxyphenyl)-3,3-dimethylbutanamide
CID 76892238

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide (CID 70327472) is (2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide is C=C(c1cc(OC)cc(OC)c1)c1ccc(OC)c(NC(=O)[C@@H](C)N)c1.
What is the InChIKey of (2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide?
The InChIKey is WWTCDIZPJPPKET-CYBMUJFWSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-12(15-8-16(24-3)11-17(9-15)25-4)14-6-7-19(26-5)18(10-14)22-20(23)13(2)21/h6-11,13H,1,21H2,2-5H3,(H,22,23)/t13-/m1/s1.
What are the key properties of (2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide?
(2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide has a molecular weight of 356.42 g/mol, XLogP of 3.06, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[5-[1-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]propanamide is sourced from PubChem (CID 70327472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).