N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide

C15H24N2O2 — CID 78818766

IUPACN,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide
SMILESCc1cccc(OCCN(C)C(C)C(=O)N(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-12-7-6-8-14(11-12)19-10-9-17(5)13(2)15(18)16(3)4/h6-8,11,13H,9-10H2,1-5H3
InChIKeyPQOVCCIQIKZWDE-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.78
Rot. Bonds6

About N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide

N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide (PubChem CID 78818766) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide
PubChem CID78818766
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide
SMILESCc1cccc(OCCN(C)C(C)C(=O)N(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-12-7-6-8-14(11-12)19-10-9-17(5)13(2)15(18)16(3)4/h6-8,11,13H,9-10H2,1-5H3
InChIKeyPQOVCCIQIKZWDE-UHFFFAOYSA-N
XLogP1.78
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-3-(3-methylphenoxy)propanamide
CID 60637097
N-[(2,4-dimethylphenyl)carbamoyl]-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide
CID 55533625
(2S)-2-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]butanamide;hydrochloride
CID 119274564
2-[2-(3-fluorophenoxy)ethyl-methylamino]propanamide
CID 47286834
N-(2-bromoethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide
CID 80666425
N,2,2-trimethyl-N-[2-(3-methylphenoxy)ethyl]propanamide
CID 60676012
2-amino-4-methoxy-N-methyl-N-[2-(3-methylphenoxy)ethyl]butanamide
CID 62474656
2,2,2-trifluoro-N-methyl-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 62492492
N-methyl-N-[2-(3-methylphenoxy)ethyl]butanamide
CID 60676013
N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide
CID 43573145
N-(3-hydroxybutyl)-N-methyl-3-(3-methylphenoxy)propanamide
CID 115691597
4-[(1R)-1-[methyl-[2-(3-methylphenoxy)ethyl]amino]ethyl]benzenesulfonamide
CID 35887109

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide?
The IUPAC name of N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide (CID 78818766) is N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide.
What is the SMILES notation for N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide?
The canonical SMILES for N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide is Cc1cccc(OCCN(C)C(C)C(=O)N(C)C)c1.
What is the InChIKey of N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide?
The InChIKey is PQOVCCIQIKZWDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12-7-6-8-14(11-12)19-10-9-17(5)13(2)15(18)16(3)4/h6-8,11,13H,9-10H2,1-5H3.
What are the key properties of N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide?
N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide has a molecular weight of 264.37 g/mol, XLogP of 1.78, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]propanamide is sourced from PubChem (CID 78818766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).