3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide

C16H24N2O3 — CID 110643090

IUPAC3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide
SMILESCOc1ccccc1CCC(=O)NOCCN1CCCC1
InChIInChI=1S/C16H24N2O3/c1-20-15-7-3-2-6-14(15)8-9-16(19)17-21-13-12-18-10-4-5-11-18/h2-3,6-7H,4-5,8-13H2,1H3,(H,17,19)
InChIKeyUZSVQSMGPQQORM-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.77
Rot. Bonds8

About 3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide

3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide (PubChem CID 110643090) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide
PubChem CID110643090
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide
SMILESCOc1ccccc1CCC(=O)NOCCN1CCCC1
InChIInChI=1S/C16H24N2O3/c1-20-15-7-3-2-6-14(15)8-9-16(19)17-21-13-12-18-10-4-5-11-18/h2-3,6-7H,4-5,8-13H2,1H3,(H,17,19)
InChIKeyUZSVQSMGPQQORM-UHFFFAOYSA-N
XLogP1.77
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-methyl-3-[2-(4-piperidin-1-ylbutoxy)phenyl]propanamide
CID 20719073
3-(2-methoxyphenyl)-N-methyl-N-(2-piperidin-1-ylethyl)propanamide
CID 110753414
3-phenoxy-N-(2-pyrrolidin-1-ylethoxy)propanamide
CID 110643041
3-(2-methoxyphenyl)-N-(2-methyl-2-piperidin-1-ylpropyl)propanamide
CID 51164305
3-(2-methoxyphenyl)-N-sulfanylpropanamide
CID 134582208
3-(2-methoxyphenyl)-1-[4-(2-pyrrolidin-1-ylethyl)-2,3-dihydroquinoxalin-1-yl]propan-1-one
CID 110361480
3-(4-acetylpiperazin-1-yl)-N-[2-(2-methoxyphenyl)ethyl]propanamide
CID 109018289
N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide
CID 8901770
methyl 4-[3-(2-methoxyphenyl)propanoyl]piperazine-1-carboxylate
CID 110365875
2-(azocan-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 51170947
3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide
CID 79675926
3-(2-methoxyphenyl)-N-phenylpropanamide
CID 7732837

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide?
The IUPAC name of 3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide (CID 110643090) is 3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide.
What is the SMILES notation for 3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide?
The canonical SMILES for 3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide is COc1ccccc1CCC(=O)NOCCN1CCCC1.
What is the InChIKey of 3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide?
The InChIKey is UZSVQSMGPQQORM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-20-15-7-3-2-6-14(15)8-9-16(19)17-21-13-12-18-10-4-5-11-18/h2-3,6-7H,4-5,8-13H2,1H3,(H,17,19).
What are the key properties of 3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide?
3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide has a molecular weight of 292.38 g/mol, XLogP of 1.77, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethoxy)propanamide is sourced from PubChem (CID 110643090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).