3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide

C14H22N2O3 — CID 115180756

IUPAC3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide
SMILESCCc1cc(CCNC(=O)C(O)CN)ccc1OC
InChIInChI=1S/C14H22N2O3/c1-3-11-8-10(4-5-13(11)19-2)6-7-16-14(18)12(17)9-15/h4-5,8,12,17H,3,6-7,9,15H2,1-2H3,(H,16,18)
InChIKeyCOXPHRCVLPWJKI-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.24
Rot. Bonds7

About 3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide

3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide (PubChem CID 115180756) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide.

Molecular Properties

Compound Name3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide
PubChem CID115180756
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide
SMILESCCc1cc(CCNC(=O)C(O)CN)ccc1OC
InChIInChI=1S/C14H22N2O3/c1-3-11-8-10(4-5-13(11)19-2)6-7-16-14(18)12(17)9-15/h4-5,8,12,17H,3,6-7,9,15H2,1-2H3,(H,16,18)
InChIKeyCOXPHRCVLPWJKI-UHFFFAOYSA-N
XLogP0.24
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3-ethyl-4-methoxyphenyl)ethyl]propanamide
CID 110788746
2-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-3-methylbutane-1,2-diamine
CID 115138276
3-amino-2-hydroxy-N-[2-(4-methylphenyl)ethyl]propanamide
CID 115180718
ethyl 3-(3-ethyl-4-methoxyphenyl)propanoate
CID 58566699
1-acetyl-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]piperidine-4-carboxamide
CID 110795515
methyl N-[2-(5-ethyl-2-methoxyphenyl)ethyl]carbamate
CID 110788778
N-[2-(5-ethyl-2-methoxyphenyl)ethyl]carbamoyl chloride
CID 115194910
3-amino-2-hydroxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]propanamide
CID 115180759
2-[2-(3-ethyl-4-methoxyphenyl)ethylamino]-3-methylbutan-1-ol
CID 115137703
4-[2-(3-ethyl-4-methoxyphenyl)ethylamino]butan-1-ol
CID 115217777
3-amino-2-hydroxy-N-[(2-methoxy-4,5-dimethylphenyl)methyl]propanamide
CID 115180522
N-[2-(3-ethyl-4-methoxyphenyl)ethyl]cyclopropanamine
CID 94682821

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide?
The IUPAC name of 3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide (CID 115180756) is 3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide.
What is the SMILES notation for 3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide?
The canonical SMILES for 3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide is CCc1cc(CCNC(=O)C(O)CN)ccc1OC.
What is the InChIKey of 3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide?
The InChIKey is COXPHRCVLPWJKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-3-11-8-10(4-5-13(11)19-2)6-7-16-14(18)12(17)9-15/h4-5,8,12,17H,3,6-7,9,15H2,1-2H3,(H,16,18).
What are the key properties of 3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide?
3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide has a molecular weight of 266.34 g/mol, XLogP of 0.24, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]-2-hydroxypropanamide is sourced from PubChem (CID 115180756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).