N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide

C16H26N2O2 — CID 63640123

IUPACN,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide
SMILESCCCNC(C)c1ccc(C)cc1OCC(=O)N(C)C
InChIInChI=1S/C16H26N2O2/c1-6-9-17-13(3)14-8-7-12(2)10-15(14)20-11-16(19)18(4)5/h7-8,10,13,17H,6,9,11H2,1-5H3
InChIKeyJUHQFUYDAGIUIV-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.52
Rot. Bonds7

About N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide

N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide (PubChem CID 63640123) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide
PubChem CID63640123
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide
SMILESCCCNC(C)c1ccc(C)cc1OCC(=O)N(C)C
InChIInChI=1S/C16H26N2O2/c1-6-9-17-13(3)14-8-7-12(2)10-15(14)20-11-16(19)18(4)5/h7-8,10,13,17H,6,9,11H2,1-5H3
InChIKeyJUHQFUYDAGIUIV-UHFFFAOYSA-N
XLogP2.52
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-fluoro-2-[1-(propylamino)ethyl]phenoxy]-N,N-dimethylacetamide
CID 63066754
2-[5-methoxy-2-[1-(propylamino)ethyl]phenoxy]-N,N-dimethylacetamide
CID 82000377
N,N-dimethyl-2-[5-methyl-2-[1-(methylamino)ethyl]phenoxy]acetamide
CID 63639445
2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]-N-propylacetamide
CID 63640126
propan-2-yl 2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetate
CID 63641331
3-[2-[1-(ethylamino)ethyl]-5-methylphenoxy]-N,N-dimethylpropanamide
CID 63640822
3-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]propanamide
CID 63639953
2-[2-[1-(ethylamino)ethyl]-5-methylphenoxy]-N-methyl-N-propan-2-ylacetamide
CID 63640979
N-(cyanomethyl)-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide
CID 63640138
N-[1-[2-(2-methoxyethoxy)-4-methylphenyl]ethyl]propan-1-amine
CID 55246297
N-[1-[4-methyl-2-(3,3,3-trifluoropropoxy)phenyl]ethyl]propan-1-amine
CID 64554154
2-[2-[1-(ethylamino)ethyl]-5-methylphenoxy]-N,N-dimethylpropanamide
CID 63640841

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide?
The IUPAC name of N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide (CID 63640123) is N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide?
The canonical SMILES for N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide is CCCNC(C)c1ccc(C)cc1OCC(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide?
The InChIKey is JUHQFUYDAGIUIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-6-9-17-13(3)14-8-7-12(2)10-15(14)20-11-16(19)18(4)5/h7-8,10,13,17H,6,9,11H2,1-5H3.
What are the key properties of N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide?
N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide has a molecular weight of 278.40 g/mol, XLogP of 2.52, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide is sourced from PubChem (CID 63640123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).