N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide

C14H22N2O2 — CID 115666155

IUPACN-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide
SMILESCCN(CCCO)CC(=O)NCc1ccccc1
InChIInChI=1S/C14H22N2O2/c1-2-16(9-6-10-17)12-14(18)15-11-13-7-4-3-5-8-13/h3-5,7-8,17H,2,6,9-12H2,1H3,(H,15,18)
InChIKeyDBNWGOUJPWZVMA-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.01
Rot. Bonds8

About N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide

N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide (PubChem CID 115666155) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide
PubChem CID115666155
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide
SMILESCCN(CCCO)CC(=O)NCc1ccccc1
InChIInChI=1S/C14H22N2O2/c1-2-16(9-6-10-17)12-14(18)15-11-13-7-4-3-5-8-13/h3-5,7-8,17H,2,6,9-12H2,1H3,(H,15,18)
InChIKeyDBNWGOUJPWZVMA-UHFFFAOYSA-N
XLogP1.01
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-[ethyl(propyl)amino]acetamide
CID 142231835
N-benzyl-2-(diethylamino)acetamide
CID 969777
2-[ethyl(3-hydroxypropyl)amino]-N-(2-phenylethyl)acetamide
CID 115666394
2-[3-[[2-(benzylamino)-2-oxoethyl]-[2-[bis(carboxymethyl)amino]ethyl]amino]propyl-(carboxymethyl)amino]acetic acid
CID 102214545
N-benzyl-2-[(3-chlorophenyl)methyl-ethylamino]acetamide
CID 52682333
2-[ethyl(3-hydroxypropyl)amino]-N-(2-fluorophenyl)acetamide
CID 113246293
N-[(3,5-difluorophenyl)methyl]-2-[ethyl(2-hydroxyethyl)amino]acetamide
CID 110898971
2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylsulfanylphenyl)acetamide
CID 115669636
2-[ethyl(3-hydroxypropyl)amino]-N-(2-thiophen-2-ylethyl)acetamide
CID 115666347
N-ethyl-2-[ethyl-(4-oxo-4-phenylbutyl)amino]acetamide
CID 60695594
N-benzyl-N'-butyl-N'-methylpropanediamide
CID 108945252
3-[[2-(benzylamino)-2-oxoethyl]-(2-hydroxypropyl)amino]propanoic acid
CID 82326877

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide?
The IUPAC name of N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide (CID 115666155) is N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide.
What is the SMILES notation for N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide?
The canonical SMILES for N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide is CCN(CCCO)CC(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide?
The InChIKey is DBNWGOUJPWZVMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-2-16(9-6-10-17)12-14(18)15-11-13-7-4-3-5-8-13/h3-5,7-8,17H,2,6,9-12H2,1H3,(H,15,18).
What are the key properties of N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide?
N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide has a molecular weight of 250.34 g/mol, XLogP of 1.01, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[ethyl(3-hydroxypropyl)amino]acetamide is sourced from PubChem (CID 115666155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).