2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide

C18H28N2O2 — CID 110621926

IUPAC2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide
SMILESCCOc1ccc(C(CNC(=O)C(C)C2CC2)N(C)C)cc1
InChIInChI=1S/C18H28N2O2/c1-5-22-16-10-8-15(9-11-16)17(20(3)4)12-19-18(21)13(2)14-6-7-14/h8-11,13-14,17H,5-7,12H2,1-4H3,(H,19,21)
InChIKeyMLXOCJRWHRUCSZ-UHFFFAOYSA-N
MW304.43 g/mol
LogP2.85
Rot. Bonds8

About 2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide

2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide (PubChem CID 110621926) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is 2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide
PubChem CID110621926
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC Name2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide
SMILESCCOc1ccc(C(CNC(=O)C(C)C2CC2)N(C)C)cc1
InChIInChI=1S/C18H28N2O2/c1-5-22-16-10-8-15(9-11-16)17(20(3)4)12-19-18(21)13(2)14-6-7-14/h8-11,13-14,17H,5-7,12H2,1-4H3,(H,19,21)
InChIKeyMLXOCJRWHRUCSZ-UHFFFAOYSA-N
XLogP2.85
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]-1,1-diethylurea
CID 112503851
2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 110621760
N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]-4-methoxybenzamide
CID 45001600
N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]-2-(4-methylphenoxy)acetamide
CID 45001670
N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]-2-(4-fluorophenyl)acetamide
CID 45001623
2-cyclopropyl-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]propanamide
CID 110621193
N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]-3,4-difluorobenzamide
CID 45001628
N-[(2S)-2-(dimethylamino)-2-[4-(dimethylamino)phenyl]ethyl]-N'-(4-ethoxyphenyl)oxamide
CID 7192210
N-[(2S)-2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 35582660
N-[(2S)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-5-(4-ethoxyphenyl)-1,2-oxazole-3-carboxamide
CID 39866714
1-cyclopropyl-3-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]urea
CID 112501881
1-[(2R)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-3-(4-ethoxyphenyl)thiourea
CID 8656372

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide?
The IUPAC name of 2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide (CID 110621926) is 2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide.
What is the SMILES notation for 2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide?
The canonical SMILES for 2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide is CCOc1ccc(C(CNC(=O)C(C)C2CC2)N(C)C)cc1.
What is the InChIKey of 2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide?
The InChIKey is MLXOCJRWHRUCSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-5-22-16-10-8-15(9-11-16)17(20(3)4)12-19-18(21)13(2)14-6-7-14/h8-11,13-14,17H,5-7,12H2,1-4H3,(H,19,21).
What are the key properties of 2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide?
2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide has a molecular weight of 304.43 g/mol, XLogP of 2.85, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]propanamide is sourced from PubChem (CID 110621926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).