3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide

C19H30N2O3 — CID 95326565

IUPAC3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide
SMILESCCOc1ccc(CCC(=O)NC[C@@H](C)N2CCOC[C@@H]2C)cc1
InChIInChI=1S/C19H30N2O3/c1-4-24-18-8-5-17(6-9-18)7-10-19(22)20-13-15(2)21-11-12-23-14-16(21)3/h5-6,8-9,15-16H,4,7,10-14H2,1-3H3,(H,20,22)/t15-,16+/m1/s1
InChIKeyOQZSMKURVPAMKQ-CVEARBPZSA-N
MW334.46 g/mol
LogP2.24
Rot. Bonds8

About 3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide

3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide (PubChem CID 95326565) has the molecular formula C19H30N2O3 and a molecular weight of 334.46 g/mol. Its IUPAC name is 3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide.

Molecular Properties

Compound Name3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide
PubChem CID95326565
Molecular FormulaC19H30N2O3
Molecular Weight334.46 g/mol
Exact Mass334.23
IUPAC Name3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide
SMILESCCOc1ccc(CCC(=O)NC[C@@H](C)N2CCOC[C@@H]2C)cc1
InChIInChI=1S/C19H30N2O3/c1-4-24-18-8-5-17(6-9-18)7-10-19(22)20-13-15(2)21-11-12-23-14-16(21)3/h5-6,8-9,15-16H,4,7,10-14H2,1-3H3,(H,20,22)/t15-,16+/m1/s1
InChIKeyOQZSMKURVPAMKQ-CVEARBPZSA-N
XLogP2.24
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminopropyl)-3-(4-ethoxyphenyl)propanamide
CID 110833167
3,3,3-trifluoro-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide
CID 98799112
cis-(1S,2R)-2-methyl-N-[(2R)-2-[(3R)-3-methylmorpholin-4-yl]propyl]cyclopropane-1-carboxamide
CID 124803825
(3R)-3-methyl-N-[2-[4-(2-methylpropoxy)phenyl]ethyl]morpholine-4-carboxamide
CID 136581270
2-(4-ethoxyphenyl)-N-(2-piperidin-1-ylpropyl)acetamide
CID 112502322
N-(3-ethyl-2-morpholin-4-ylpentyl)-3-(4-methoxyphenyl)propanamide
CID 75691751
3-(4-methoxyphenyl)-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 44892273
3-(3,4-diethoxyphenyl)-N-(2-methylpropyl)propanamide
CID 92680043
3-(4-ethoxy-3-methoxyphenyl)-N-(2-methylpropyl)propanamide
CID 19221699
1-ethyl-3-[2-(3-methylmorpholin-4-yl)propyl]-2-[[4-(trifluoromethyl)phenyl]methyl]guanidine
CID 111840579
N-[2-(4-ethoxyphenyl)ethyl]-3-(4-hydroxyphenyl)propanamide
CID 174483925
1-ethyl-2-[(3-methoxyphenyl)methyl]-3-[2-(3-methylmorpholin-4-yl)propyl]guanidine;hydroiodide
CID 111836986

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide?
The IUPAC name of 3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide (CID 95326565) is 3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide.
What is the SMILES notation for 3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide?
The canonical SMILES for 3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide is CCOc1ccc(CCC(=O)NC[C@@H](C)N2CCOC[C@@H]2C)cc1.
What is the InChIKey of 3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide?
The InChIKey is OQZSMKURVPAMKQ-CVEARBPZSA-N. The full InChI is InChI=1S/C19H30N2O3/c1-4-24-18-8-5-17(6-9-18)7-10-19(22)20-13-15(2)21-11-12-23-14-16(21)3/h5-6,8-9,15-16H,4,7,10-14H2,1-3H3,(H,20,22)/t15-,16+/m1/s1.
What are the key properties of 3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide?
3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide has a molecular weight of 334.46 g/mol, XLogP of 2.24, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxyphenyl)-N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]propyl]propanamide is sourced from PubChem (CID 95326565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).