3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide

C21H34N2O2 — CID 110301496

IUPAC3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide
SMILESCCN(CC)C(C)CNC(=O)CC(c1ccc(OC)c(C)c1)C1CC1
InChIInChI=1S/C21H34N2O2/c1-6-23(7-2)16(4)14-22-21(24)13-19(17-8-9-17)18-10-11-20(25-5)15(3)12-18/h10-12,16-17,19H,6-9,13-14H2,1-5H3,(H,22,24)
InChIKeyMXLPRFPLFRPTKN-UHFFFAOYSA-N
MW346.52 g/mol
LogP3.73
Rot. Bonds10

About 3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide

3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide (PubChem CID 110301496) has the molecular formula C21H34N2O2 and a molecular weight of 346.52 g/mol. Its IUPAC name is 3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide.

Molecular Properties

Compound Name3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide
PubChem CID110301496
Molecular FormulaC21H34N2O2
Molecular Weight346.52 g/mol
Exact Mass346.26
IUPAC Name3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide
SMILESCCN(CC)C(C)CNC(=O)CC(c1ccc(OC)c(C)c1)C1CC1
InChIInChI=1S/C21H34N2O2/c1-6-23(7-2)16(4)14-22-21(24)13-19(17-8-9-17)18-10-11-20(25-5)15(3)12-18/h10-12,16-17,19H,6-9,13-14H2,1-5H3,(H,22,24)
InChIKeyMXLPRFPLFRPTKN-UHFFFAOYSA-N
XLogP3.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.52
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methylphenyl)propanamide
CID 110301493
3-cyclopropyl-N-(2-hydroxy-2-methylpropyl)-3-(4-methoxy-3-methylphenyl)propanamide
CID 110306820
3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(4-methoxyphenyl)methyl]propanamide
CID 110297458
3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-(2-oxo-2-piperidin-1-ylethyl)propanamide
CID 110312177
3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide
CID 110310845
3-cyclopropyl-3-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)propanamide
CID 110407527
3-cyclopropyl-3-(3,4-dimethoxyphenyl)-N-(3-methylbutyl)propanamide
CID 110415573
ethyl 4-[3-cyclopropyl-3-(4-methoxy-3-methylphenyl)propanoyl]piperazine-1-carboxylate
CID 110297471
3-cyclopropyl-N-[3-(dimethylamino)propyl]-3-(3,4-dimethylphenyl)propanamide
CID 110408201
3-cyclopropyl-3-(3,4-dimethoxyphenyl)-N-(2-methylsulfonylethyl)propanamide
CID 110425232
3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 110413285
3-cyclopropyl-3-(3,4-dimethoxyphenyl)-N-methoxypropanamide
CID 110611785

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide?
The IUPAC name of 3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide (CID 110301496) is 3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide.
What is the SMILES notation for 3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide?
The canonical SMILES for 3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide is CCN(CC)C(C)CNC(=O)CC(c1ccc(OC)c(C)c1)C1CC1.
What is the InChIKey of 3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide?
The InChIKey is MXLPRFPLFRPTKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H34N2O2/c1-6-23(7-2)16(4)14-22-21(24)13-19(17-8-9-17)18-10-11-20(25-5)15(3)12-18/h10-12,16-17,19H,6-9,13-14H2,1-5H3,(H,22,24).
What are the key properties of 3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide?
3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide has a molecular weight of 346.52 g/mol, XLogP of 3.73, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide is sourced from PubChem (CID 110301496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).