N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide

C16H26N2O2 — CID 43280198

IUPACN,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide
SMILESCCCNC(CC)c1ccc(OCC(=O)N(C)C)cc1
InChIInChI=1S/C16H26N2O2/c1-5-11-17-15(6-2)13-7-9-14(10-8-13)20-12-16(19)18(3)4/h7-10,15,17H,5-6,11-12H2,1-4H3
InChIKeyOQYAILRSOXGXHE-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.60
Rot. Bonds8

About N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide

N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide (PubChem CID 43280198) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide
PubChem CID43280198
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide
SMILESCCCNC(CC)c1ccc(OCC(=O)N(C)C)cc1
InChIInChI=1S/C16H26N2O2/c1-5-11-17-15(6-2)13-7-9-14(10-8-13)20-12-16(19)18(3)4/h7-10,15,17H,5-6,11-12H2,1-4H3
InChIKeyOQYAILRSOXGXHE-UHFFFAOYSA-N
XLogP2.60
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[(1R)-1-aminopropyl]phenoxy]-N,N-dimethylacetamide
CID 30078683
1-(4-pentoxyphenyl)-N-propylpropan-1-amine
CID 43280171
3-[4-[1-(propylamino)propyl]phenoxy]propane-1,2-diol
CID 82850496
1-[4-(2-methylsulfonylethoxy)phenyl]-N-propylpropan-1-amine
CID 60915678
N-ethyl-2-[4-[1-(ethylamino)propyl]phenoxy]acetamide
CID 43280159
1-[4-[(E)-but-2-enoxy]phenyl]-N-propylpropan-1-amine
CID 60887233
N-cyclopropyl-N-methyl-2-[4-[1-(methylamino)propyl]phenoxy]acetamide
CID 61488716
3-(4-ethoxyphenyl)-3-(propylamino)propan-1-ol
CID 64812605
1-(4-ethoxyphenyl)-3-methyl-N-propylpentan-1-amine
CID 114874341
2-[4-(2-aminobutyl)phenoxy]-N,N-dimethylacetamide
CID 54930931
2-[5-methoxy-2-[1-(propylamino)ethyl]phenoxy]-N,N-dimethylacetamide
CID 82000377
3-[4-[1-(ethylamino)propyl]phenoxy]propanamide
CID 43280110

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide?
The IUPAC name of N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide (CID 43280198) is N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide?
The canonical SMILES for N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide is CCCNC(CC)c1ccc(OCC(=O)N(C)C)cc1.
What is the InChIKey of N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide?
The InChIKey is OQYAILRSOXGXHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-5-11-17-15(6-2)13-7-9-14(10-8-13)20-12-16(19)18(3)4/h7-10,15,17H,5-6,11-12H2,1-4H3.
What are the key properties of N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide?
N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide has a molecular weight of 278.40 g/mol, XLogP of 2.60, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[4-[1-(propylamino)propyl]phenoxy]acetamide is sourced from PubChem (CID 43280198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).