N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide

C15H24N2O2 — CID 111488425

IUPACN-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide
SMILESCCc1ccccc1NC(=O)CN(C)CCC(C)O
InChIInChI=1S/C15H24N2O2/c1-4-13-7-5-6-8-14(13)16-15(19)11-17(3)10-9-12(2)18/h5-8,12,18H,4,9-11H2,1-3H3,(H,16,19)
InChIKeyJDDUGPKQVHWCSI-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.89
Rot. Bonds7

About N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide

N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide (PubChem CID 111488425) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide
PubChem CID111488425
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide
SMILESCCc1ccccc1NC(=O)CN(C)CCC(C)O
InChIInChI=1S/C15H24N2O2/c1-4-13-7-5-6-8-14(13)16-15(19)11-17(3)10-9-12(2)18/h5-8,12,18H,4,9-11H2,1-3H3,(H,16,19)
InChIKeyJDDUGPKQVHWCSI-UHFFFAOYSA-N
XLogP1.89
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-hydroxybutyl(methyl)amino]-N-(2-propan-2-ylphenyl)acetamide
CID 115665846
N-(2-cyanophenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide
CID 115666891
N-(2-ethylphenyl)-2-[(4-ethylphenyl)methyl-methylamino]acetamide
CID 27095559
2-[[(2S)-2,4-dimethylpentyl]-methylamino]-N-(2-ethylphenyl)acetamide
CID 100703004
N-[2-(aminomethyl)phenyl]-2-[methyl(propyl)amino]acetamide
CID 43270948
2-[[2-[[2-(2-ethylanilino)-2-oxoethyl]-methylamino]acetyl]amino]benzamide
CID 18135262
2-[(4-bromophenyl)methyl-methylamino]-N-(2-ethylphenyl)acetamide
CID 9039948
2-(dipropylamino)-N-(2-ethylphenyl)acetamide
CID 109006597
2-[[2-(2,6-difluorophenyl)-2-hydroxyethyl]-methylamino]-N-(2-ethylphenyl)acetamide
CID 110898303
N-[2-[(dimethylamino)methyl]phenyl]-4-hydroxypentanamide
CID 79204978
2-[[2-(3,5-dimethylanilino)-2-oxoethyl]-methylamino]-N-(2-ethylphenyl)acetamide
CID 9304031
2-[[2-(2-ethylanilino)-2-oxoethyl]-methylamino]-N-prop-2-ynylacetamide
CID 8789459

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide?
The IUPAC name of N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide (CID 111488425) is N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide.
What is the SMILES notation for N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide?
The canonical SMILES for N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide is CCc1ccccc1NC(=O)CN(C)CCC(C)O.
What is the InChIKey of N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide?
The InChIKey is JDDUGPKQVHWCSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-13-7-5-6-8-14(13)16-15(19)11-17(3)10-9-12(2)18/h5-8,12,18H,4,9-11H2,1-3H3,(H,16,19).
What are the key properties of N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide?
N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.89, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide is sourced from PubChem (CID 111488425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).