N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide

C15H24N2O — CID 143915548

IUPACN-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide
SMILESCCCN(CC)Cc1cccc(CNC(C)=O)c1
InChIInChI=1S/C15H24N2O/c1-4-9-17(5-2)12-15-8-6-7-14(10-15)11-16-13(3)18/h6-8,10H,4-5,9,11-12H2,1-3H3,(H,16,18)
InChIKeyWZERUWSAIWIWRN-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.55
Rot. Bonds7

About N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide

N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide (PubChem CID 143915548) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide
PubChem CID143915548
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide
SMILESCCCN(CC)Cc1cccc(CNC(C)=O)c1
InChIInChI=1S/C15H24N2O/c1-4-9-17(5-2)12-15-8-6-7-14(10-15)11-16-13(3)18/h6-8,10H,4-5,9,11-12H2,1-3H3,(H,16,18)
InChIKeyWZERUWSAIWIWRN-UHFFFAOYSA-N
XLogP2.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[3-(diethylaminomethyl)phenyl]methyl]-2-(methylamino)acetamide;hydrochloride
CID 120703880
N-[[3-(diethylaminomethyl)phenyl]methyl]-N',N'-dipropylpentanediamide
CID 56545187
1-amino-N-[[3-[[butyl(ethyl)amino]methyl]phenyl]methyl]cyclopentane-1-carboxamide
CID 119898241
N-[[3-(diethylaminomethyl)phenyl]methyl]ethanamine
CID 46785465
N-[[3-[(dipropylamino)methyl]phenyl]methyl]propan-1-amine
CID 55070121
N-[[3-(diethylaminomethyl)phenyl]methyl]-3-(4-ethylphenyl)propanamide
CID 55768894
N-[[3-[(4-chloro-N-methylanilino)methyl]phenyl]methyl]acetamide
CID 143248637
N-[[3-(diethylaminomethyl)phenyl]methyl]furan-3-carboxamide
CID 47046081
N-benzyl-2-[ethyl(propyl)amino]acetamide
CID 142231835
2-[propyl-[(3-propylphenyl)methyl]amino]acetic acid
CID 122040180
N-[2-[[3-(diethylaminomethyl)phenyl]methylamino]-2-oxoethyl]-3-fluorobenzamide
CID 78902086
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[[3-[[butyl(ethyl)amino]methyl]phenyl]methyl]acetamide
CID 119898247

Frequently Asked Questions

What is the IUPAC name of N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide?
The IUPAC name of N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide (CID 143915548) is N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide.
What is the SMILES notation for N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide?
The canonical SMILES for N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide is CCCN(CC)Cc1cccc(CNC(C)=O)c1.
What is the InChIKey of N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide?
The InChIKey is WZERUWSAIWIWRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-9-17(5-2)12-15-8-6-7-14(10-15)11-16-13(3)18/h6-8,10H,4-5,9,11-12H2,1-3H3,(H,16,18).
What are the key properties of N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide?
N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide has a molecular weight of 248.37 g/mol, XLogP of 2.55, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide is sourced from PubChem (CID 143915548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).