N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide

C14H20N2O2 — CID 113051974

IUPACN-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide
SMILESCC(=O)N(CCNC(=O)c1ccccc1)C(C)C
InChIInChI=1S/C14H20N2O2/c1-11(2)16(12(3)17)10-9-15-14(18)13-7-5-4-6-8-13/h4-8,11H,9-10H2,1-3H3,(H,15,18)
InChIKeyDFDPHJVYUVEPKX-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.67
Rot. Bonds5

About N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide

N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide (PubChem CID 113051974) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide.

Molecular Properties

Compound NameN-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide
PubChem CID113051974
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide
SMILESCC(=O)N(CCNC(=O)c1ccccc1)C(C)C
InChIInChI=1S/C14H20N2O2/c1-11(2)16(12(3)17)10-9-15-14(18)13-7-5-4-6-8-13/h4-8,11H,9-10H2,1-3H3,(H,15,18)
InChIKeyDFDPHJVYUVEPKX-UHFFFAOYSA-N
XLogP1.67
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[acetyl(propan-2-yl)amino]ethyl]-4-methoxybenzamide
CID 113051986
N-[2-[acetyl(propan-2-yl)amino]ethyl]-3,4-dichlorobenzamide
CID 113051988
N-[2-[acetyl(propan-2-yl)amino]ethyl]-3,4-difluorobenzamide
CID 113052022
N-[2-[acetyl(propan-2-yl)amino]ethyl]-2,6-dimethoxybenzamide
CID 113051989
N-[3-[3-hydroxypropyl(propan-2-yl)amino]-3-oxopropyl]benzamide
CID 61038662
N-[3-[3-benzamidopropyl(methyl)amino]propyl]benzamide
CID 67474503
N-[2-[acetyl(1-phenylethyl)amino]ethyl]-3,4-difluorobenzamide
CID 113054471
N-[2-[3-methylbutyl(methylsulfonyl)amino]ethyl]benzamide
CID 113068205
1-N,4-N-bis[2-(N-methylanilino)ethyl]benzene-1,4-dicarboxamide
CID 35617422
N-[2-(N-acetyl-4-propan-2-yloxyanilino)ethyl]benzamide
CID 113061087
N-benzyl-N-propan-2-ylacetamide
CID 23534449
N-(2-aminoethyl)benzamide;ethane
CID 143976252

Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide?
The IUPAC name of N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide (CID 113051974) is N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide.
What is the SMILES notation for N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide?
The canonical SMILES for N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide is CC(=O)N(CCNC(=O)c1ccccc1)C(C)C.
What is the InChIKey of N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide?
The InChIKey is DFDPHJVYUVEPKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-11(2)16(12(3)17)10-9-15-14(18)13-7-5-4-6-8-13/h4-8,11H,9-10H2,1-3H3,(H,15,18).
What are the key properties of N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide?
N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide has a molecular weight of 248.33 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide is sourced from PubChem (CID 113051974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).