(2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide

C15H25N3O3 — CID 104905112

IUPAC(2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide
SMILESCOCCN(C)CCNC(=O)[C@H](N)Cc1ccc(O)cc1
InChIInChI=1S/C15H25N3O3/c1-18(9-10-21-2)8-7-17-15(20)14(16)11-12-3-5-13(19)6-4-12/h3-6,14,19H,7-11,16H2,1-2H3,(H,17,20)/t14-/m1/s1
InChIKeyOEDPIECOCRHUJK-CQSZACIVSA-N
MW295.38 g/mol
LogP-0.04
Rot. Bonds9

About (2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide

(2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide (PubChem CID 104905112) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is (2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide
PubChem CID104905112
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC Name(2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide
SMILESCOCCN(C)CCNC(=O)[C@H](N)Cc1ccc(O)cc1
InChIInChI=1S/C15H25N3O3/c1-18(9-10-21-2)8-7-17-15(20)14(16)11-12-3-5-13(19)6-4-12/h3-6,14,19H,7-11,16H2,1-2H3,(H,17,20)/t14-/m1/s1
InChIKeyOEDPIECOCRHUJK-CQSZACIVSA-N
XLogP-0.04
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 5-0.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-3-(4-hydroxyphenyl)-N-[2-[methyl(propan-2-yl)amino]ethyl]propanamide
CID 76947546
(2S)-2-amino-3-(4-hydroxyphenyl)-N,N-bis(2-methoxyethyl)propanamide
CID 61154746
(2S)-2-amino-N-(2-hydroxyethyl)-3-(4-hydroxyphenyl)propanamide
CID 61155006
(2R)-2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-(4-hydroxyphenyl)propanamide
CID 104904975
methyl 4-[[(2R)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]butanoate
CID 104904977
(2R)-2-amino-N-(3-ethoxypropyl)-3-(4-hydroxyphenyl)propanamide
CID 104904634
2-amino-N-ethyl-3-(4-hydroxyphenyl)-N-(2-methoxyethyl)propanamide
CID 76904317
(2S)-2-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]-3-(4-hydroxyphenyl)propanamide
CID 106236638
(2R)-2-amino-N-(3-amino-3-oxopropyl)-3-(4-hydroxyphenyl)propanamide
CID 104904759
(2S)-2-amino-N-(3-amino-3-oxopropyl)-3-(4-hydroxyphenyl)propanamide
CID 61156108
(2S)-2-amino-3-(4-hydroxyphenyl)-N-(1-methoxypropan-2-yl)propanamide
CID 61148762
2-amino-N-(3-butoxypropyl)-3-(4-hydroxyphenyl)propanamide
CID 114350754

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide?
The IUPAC name of (2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide (CID 104905112) is (2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide.
What is the SMILES notation for (2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide?
The canonical SMILES for (2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide is COCCN(C)CCNC(=O)[C@H](N)Cc1ccc(O)cc1.
What is the InChIKey of (2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide?
The InChIKey is OEDPIECOCRHUJK-CQSZACIVSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-18(9-10-21-2)8-7-17-15(20)14(16)11-12-3-5-13(19)6-4-12/h3-6,14,19H,7-11,16H2,1-2H3,(H,17,20)/t14-/m1/s1.
What are the key properties of (2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide?
(2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide has a molecular weight of 295.38 g/mol, XLogP of -0.04, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-(4-hydroxyphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]propanamide is sourced from PubChem (CID 104905112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).