3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide

C14H22N2O2 — CID 62838572

IUPAC3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide
SMILESCCNCC(C)C(=O)Nc1ccccc1C(C)O
InChIInChI=1S/C14H22N2O2/c1-4-15-9-10(2)14(18)16-13-8-6-5-7-12(13)11(3)17/h5-8,10-11,15,17H,4,9H2,1-3H3,(H,16,18)
InChIKeySHGWKFXOUSUQMG-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.92
Rot. Bonds6

About 3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide

3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide (PubChem CID 62838572) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide.

Molecular Properties

Compound Name3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide
PubChem CID62838572
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide
SMILESCCNCC(C)C(=O)Nc1ccccc1C(C)O
InChIInChI=1S/C14H22N2O2/c1-4-15-9-10(2)14(18)16-13-8-6-5-7-12(13)11(3)17/h5-8,10-11,15,17H,4,9H2,1-3H3,(H,16,18)
InChIKeySHGWKFXOUSUQMG-UHFFFAOYSA-N
XLogP1.92
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide
CID 62727616
3-(ethylamino)-2-methyl-N-(2-methylphenyl)propanamide
CID 45097653
3-(ethylamino)-2-methyl-N-[2-(trifluoromethyl)phenyl]propanamide
CID 62853226
3-[2-[[3-(ethylamino)-2-methylpropanoyl]amino]phenyl]propanoic acid
CID 107273577
N-(2-butan-2-ylphenyl)-3-chloro-2-methylpropanamide
CID 55110758
N-[2,4-di(propan-2-yl)phenyl]-3-(ethylamino)-2-methylpropanamide
CID 62852532
N-[2-(1-chloroethyl)phenyl]-2-methylbutanamide
CID 114304941
N-[2-(1-hydroxyethyl)phenyl]butanamide
CID 43508507
2-methyl-N-[2-[1-(methylamino)ethyl]phenyl]butanamide
CID 43507938
2-acetamido-N-[2-(1-hydroxyethyl)phenyl]propanamide
CID 54963356
N-[2-(1-hydroxyethyl)phenyl]-2,2-dimethylbutanamide
CID 55103349
2-amino-2-ethyl-N-[2-(1-hydroxyethyl)phenyl]butanamide
CID 79813414

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide?
The IUPAC name of 3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide (CID 62838572) is 3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide.
What is the SMILES notation for 3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide?
The canonical SMILES for 3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide is CCNCC(C)C(=O)Nc1ccccc1C(C)O.
What is the InChIKey of 3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide?
The InChIKey is SHGWKFXOUSUQMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-15-9-10(2)14(18)16-13-8-6-5-7-12(13)11(3)17/h5-8,10-11,15,17H,4,9H2,1-3H3,(H,16,18).
What are the key properties of 3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide?
3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide has a molecular weight of 250.34 g/mol, XLogP of 1.92, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide is sourced from PubChem (CID 62838572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).