2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide

C14H22N2O2 — CID 55121666

IUPAC2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)NC(C)c1cccc(O)c1
InChIInChI=1S/C14H22N2O2/c1-5-15-14(3,4)13(18)16-10(2)11-7-6-8-12(17)9-11/h6-10,15,17H,5H2,1-4H3,(H,16,18)
InChIKeyOVCKIMKRTUPNEF-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.96
Rot. Bonds5

About 2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide

2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide (PubChem CID 55121666) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide
PubChem CID55121666
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)NC(C)c1cccc(O)c1
InChIInChI=1S/C14H22N2O2/c1-5-15-14(3,4)13(18)16-10(2)11-7-6-8-12(17)9-11/h6-10,15,17H,5H2,1-4H3,(H,16,18)
InChIKeyOVCKIMKRTUPNEF-UHFFFAOYSA-N
XLogP1.96
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide
CID 62833570
tert-butyl N-[(1R)-1-(3-hydroxyphenyl)ethyl]carbamate
CID 56955758
[(1S)-1-(3-hydroxyphenyl)ethyl]urea
CID 130686101
N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide
CID 62836048
1-[(1R)-1-(3-hydroxyphenyl)ethyl]-3-propylurea
CID 95239729
2-amino-N-[1-(3-hydroxyphenyl)ethyl]-3,3-dimethylbutanamide
CID 76893024
(2R)-2-amino-N-[1-(3-hydroxyphenyl)ethyl]-3,3-dimethylbutanamide
CID 113353325
2-(ethylamino)-N-[(1R)-1-(furan-2-yl)ethyl]-2-methylpropanamide
CID 81400808
(2S)-2-amino-N-[1-(3-hydroxyphenyl)ethyl]butanamide
CID 79025425
(2R)-2-[[2-(ethylamino)-2-methylpropanoyl]amino]-2-phenylacetic acid
CID 62836836
2-(butan-2-ylamino)-N-[1-(3-hydroxyphenyl)ethyl]acetamide
CID 54925343
N-[1-(3-chlorophenyl)propyl]-2-(ethylamino)-2-methylpropanamide
CID 62833393

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide?
The IUPAC name of 2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide (CID 55121666) is 2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide.
What is the SMILES notation for 2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide?
The canonical SMILES for 2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide is CCNC(C)(C)C(=O)NC(C)c1cccc(O)c1.
What is the InChIKey of 2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide?
The InChIKey is OVCKIMKRTUPNEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-5-15-14(3,4)13(18)16-10(2)11-7-6-8-12(17)9-11/h6-10,15,17H,5H2,1-4H3,(H,16,18).
What are the key properties of 2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide?
2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide has a molecular weight of 250.34 g/mol, XLogP of 1.96, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide is sourced from PubChem (CID 55121666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).