N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide

C15H24N2O — CID 60674556

IUPACN-[[2-(diethylaminomethyl)phenyl]methyl]propanamide
SMILESCCC(=O)NCc1ccccc1CN(CC)CC
InChIInChI=1S/C15H24N2O/c1-4-15(18)16-11-13-9-7-8-10-14(13)12-17(5-2)6-3/h7-10H,4-6,11-12H2,1-3H3,(H,16,18)
InChIKeyXCVGLYYYADMAGC-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.55
Rot. Bonds7

About N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide

N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide (PubChem CID 60674556) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide.

Molecular Properties

Compound NameN-[[2-(diethylaminomethyl)phenyl]methyl]propanamide
PubChem CID60674556
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[[2-(diethylaminomethyl)phenyl]methyl]propanamide
SMILESCCC(=O)NCc1ccccc1CN(CC)CC
InChIInChI=1S/C15H24N2O/c1-4-15(18)16-11-13-9-7-8-10-14(13)12-17(5-2)6-3/h7-10H,4-6,11-12H2,1-3H3,(H,16,18)
InChIKeyXCVGLYYYADMAGC-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-[[2-(diethylaminomethyl)phenyl]methyl]-2-ethoxyacetamide
CID 60676604
2-tert-butylsulfanyl-N-[[2-(diethylaminomethyl)phenyl]methyl]acetamide
CID 134022151
(3R)-3-acetamido-N-[[2-(diethylaminomethyl)phenyl]methyl]-3-phenylpropanamide
CID 9073272
2-chloro-N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide
CID 43346662
N-[[2-(diethylaminomethyl)phenyl]methyl]-2-[2-(methanesulfonamido)phenyl]acetamide
CID 86934936
3-[[2-(diethylaminomethyl)phenyl]methylamino]-2-methyl-3-oxopropanoic acid
CID 114897128
(2S)-2-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]-3,3-dimethylbutanamide
CID 119836094
(2S)-2-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]-3-methylbutanamide
CID 61259162
1-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]cyclopropane-1-carboxamide;dihydrochloride
CID 119836037
N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide
CID 134022161
2-(5-amino-2-pyridinyl)-N-[[2-(diethylaminomethyl)phenyl]methyl]acetamide
CID 120640465
4-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methylbutanamide
CID 80542266

Frequently Asked Questions

What is the IUPAC name of N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide?
The IUPAC name of N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide (CID 60674556) is N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide.
What is the SMILES notation for N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide?
The canonical SMILES for N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide is CCC(=O)NCc1ccccc1CN(CC)CC.
What is the InChIKey of N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide?
The InChIKey is XCVGLYYYADMAGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-15(18)16-11-13-9-7-8-10-14(13)12-17(5-2)6-3/h7-10H,4-6,11-12H2,1-3H3,(H,16,18).
What are the key properties of N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide?
N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide 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-[[2-(diethylaminomethyl)phenyl]methyl]propanamide is sourced from PubChem (CID 60674556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).