2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide

C14H22N2O2 — CID 54870866

IUPAC2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide
SMILESCCCCN(CCO)C(=O)C(N)c1ccccc1
InChIInChI=1S/C14H22N2O2/c1-2-3-9-16(10-11-17)14(18)13(15)12-7-5-4-6-8-12/h4-8,13,17H,2-3,9-11,15H2,1H3
InChIKeyKAGIDOVNWHWSRL-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.31
Rot. Bonds7

About 2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide

2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide (PubChem CID 54870866) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide
PubChem CID54870866
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide
SMILESCCCCN(CCO)C(=O)C(N)c1ccccc1
InChIInChI=1S/C14H22N2O2/c1-2-3-9-16(10-11-17)14(18)13(15)12-7-5-4-6-8-12/h4-8,13,17H,2-3,9-11,15H2,1H3
InChIKeyKAGIDOVNWHWSRL-UHFFFAOYSA-N
XLogP1.31
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-ethyl-N-(2-hydroxyethyl)-2-phenylacetamide;hydrochloride
CID 110897047
2-amino-N-(2-amino-2-oxoethyl)-N-butyl-2-phenylacetamide
CID 60946442
3-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylpropanamide
CID 62878005
(2R)-2-amino-N-butyl-2-phenyl-N-(2,2,2-trifluoroethyl)acetamide
CID 61164511
(2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-phenylacetamide
CID 107479341
2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide
CID 54870822
3-amino-N,N-dibutyl-2-phenyl-3-sulfanylidenepropanamide
CID 62876706
3-[(2-amino-2-phenylacetyl)-ethylamino]propanoic acid
CID 55060067
(2S)-2-amino-2-phenyl-N-prop-2-enyl-N-propylacetamide
CID 104898275
3-amino-N-ethyl-N-(2-hydroxyethyl)-2-methyl-3-phenylpropanamide
CID 80552105
(2S)-2-amino-N-(cyclopropylmethyl)-2-phenyl-N-propylacetamide
CID 93193539
methyl 2-[[(2S)-2-amino-2-phenylacetyl]-propylamino]acetate
CID 93371927

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide?
The IUPAC name of 2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide (CID 54870866) is 2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide?
The canonical SMILES for 2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide is CCCCN(CCO)C(=O)C(N)c1ccccc1.
What is the InChIKey of 2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide?
The InChIKey is KAGIDOVNWHWSRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-2-3-9-16(10-11-17)14(18)13(15)12-7-5-4-6-8-12/h4-8,13,17H,2-3,9-11,15H2,1H3.
What are the key properties of 2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide?
2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide has a molecular weight of 250.34 g/mol, XLogP of 1.31, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide is sourced from PubChem (CID 54870866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).