N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide

C19H32N2O3 — CID 133247067

IUPACN-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide
SMILESCCCOC(C)(CCC)C(=O)Nc1ccc(OCCN(C)C)cc1
InChIInChI=1S/C19H32N2O3/c1-6-12-19(3,24-14-7-2)18(22)20-16-8-10-17(11-9-16)23-15-13-21(4)5/h8-11H,6-7,12-15H2,1-5H3,(H,20,22)
InChIKeyUDLOLDIBPDCUFO-UHFFFAOYSA-N
MW336.48 g/mol
LogP3.55
Rot. Bonds11

About N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide

N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide (PubChem CID 133247067) has the molecular formula C19H32N2O3 and a molecular weight of 336.48 g/mol. Its IUPAC name is N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide.

Molecular Properties

Compound NameN-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide
PubChem CID133247067
Molecular FormulaC19H32N2O3
Molecular Weight336.48 g/mol
Exact Mass336.24
IUPAC NameN-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide
SMILESCCCOC(C)(CCC)C(=O)Nc1ccc(OCCN(C)C)cc1
InChIInChI=1S/C19H32N2O3/c1-6-12-19(3,24-14-7-2)18(22)20-16-8-10-17(11-9-16)23-15-13-21(4)5/h8-11H,6-7,12-15H2,1-5H3,(H,20,22)
InChIKeyUDLOLDIBPDCUFO-UHFFFAOYSA-N
XLogP3.55
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[3-(dimethylamino)propoxy]phenyl]-2-methyl-2-propoxypentanamide
CID 133247077
(2S)-N-[4-[3-(dimethylamino)propoxy]phenyl]-2-ethoxy-2-methylpentanamide
CID 100724805
(2R)-2-methyl-2-propoxy-N-(4-propoxyphenyl)hexanamide
CID 100741376
2-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methylpentanamide
CID 60928090
(2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)pentanamide
CID 100696786
(2R)-2-methyl-2-propoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pentanamide
CID 100739757
(2R)-2-methyl-N-[4-[2-(4-methylpiperidin-1-yl)ethoxy]phenyl]-2-propoxypentanamide
CID 100739818
N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methoxy-2,4-dimethylpentanamide
CID 133167161
N-(4-cyclopentyloxyphenyl)-2-methyl-2-propoxypentanamide
CID 133247059
N-[4-[3-(diethylamino)propoxy]phenyl]-2-methoxy-2-methylpentanamide
CID 133245961
(2R)-N-(4-methoxyphenyl)-2-methyl-2-propoxyheptanamide
CID 100742668
2-cyclopropyl-N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-ethoxypropanamide
CID 133246885

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide?
The IUPAC name of N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide (CID 133247067) is N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide.
What is the SMILES notation for N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide?
The canonical SMILES for N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide is CCCOC(C)(CCC)C(=O)Nc1ccc(OCCN(C)C)cc1.
What is the InChIKey of N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide?
The InChIKey is UDLOLDIBPDCUFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2O3/c1-6-12-19(3,24-14-7-2)18(22)20-16-8-10-17(11-9-16)23-15-13-21(4)5/h8-11H,6-7,12-15H2,1-5H3,(H,20,22).
What are the key properties of N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide?
N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide has a molecular weight of 336.48 g/mol, XLogP of 3.55, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methyl-2-propoxypentanamide is sourced from PubChem (CID 133247067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).