2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide

C13H20N2O2 — CID 114332310

IUPAC2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)NCc1ccccc1O
InChIInChI=1S/C13H20N2O2/c1-4-15-13(2,3)12(17)14-9-10-7-5-6-8-11(10)16/h5-8,15-16H,4,9H2,1-3H3,(H,14,17)
InChIKeyYIWPVNRGONLEJZ-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.40
Rot. Bonds5

About 2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide

2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide (PubChem CID 114332310) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide
PubChem CID114332310
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)NCc1ccccc1O
InChIInChI=1S/C13H20N2O2/c1-4-15-13(2,3)12(17)14-9-10-7-5-6-8-11(10)16/h5-8,15-16H,4,9H2,1-3H3,(H,14,17)
InChIKeyYIWPVNRGONLEJZ-UHFFFAOYSA-N
XLogP1.40
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

2-(ethylamino)-2-methyl-N-[(4-methylphenyl)methyl]propanamide
CID 62831732
2-(ethylamino)-N-(furan-2-ylmethyl)-2-methylpropanamide
CID 62831893
2-(ethylamino)-N-[(4-methoxyphenyl)methyl]-2-methylpropanamide
CID 62833195
2-(ethylamino)-2-methyl-N-(1,2-oxazol-5-ylmethyl)propanamide
CID 106417135
2-(ethylamino)-2-methyl-N-[(1-phenylpyrazol-4-yl)methyl]propanamide
CID 62835939
2-(ethylamino)-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-2-methylpropanamide
CID 112669318
2-[(3-methylpentan-3-ylamino)methyl]phenol
CID 115630759
3-(ethylamino)-3-methyl-1-phenylbutan-2-one
CID 116565964
N-[2-[(dimethylamino)methyl]phenyl]-2-(ethylamino)-2-methylpropanamide
CID 62832687
2-(ethylaminomethyl)phenol
CID 12995218
N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide
CID 62834293
N-[(2-aminophenyl)methyl]-2,2-dimethylbutanamide
CID 62679521

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide?
The IUPAC name of 2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide (CID 114332310) is 2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide.
What is the SMILES notation for 2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide?
The canonical SMILES for 2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide is CCNC(C)(C)C(=O)NCc1ccccc1O.
What is the InChIKey of 2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide?
The InChIKey is YIWPVNRGONLEJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-15-13(2,3)12(17)14-9-10-7-5-6-8-11(10)16/h5-8,15-16H,4,9H2,1-3H3,(H,14,17).
What are the key properties of 2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide?
2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide has a molecular weight of 236.31 g/mol, XLogP of 1.40, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[(2-hydroxyphenyl)methyl]-2-methylpropanamide is sourced from PubChem (CID 114332310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).