N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide

C19H21N3O2 — CID 38537408

IUPACN-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide
SMILESCCOc1ncccc1CNC(=O)CCc1c[nH]c2ccccc12
InChIInChI=1S/C19H21N3O2/c1-2-24-19-15(6-5-11-20-19)13-22-18(23)10-9-14-12-21-17-8-4-3-7-16(14)17/h3-8,11-12,21H,2,9-10,13H2,1H3,(H,22,23)
InChIKeyVOZBTUNPSAHPDG-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.21
Rot. Bonds7

About N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide

N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide (PubChem CID 38537408) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide.

Molecular Properties

Compound NameN-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide
PubChem CID38537408
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC NameN-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide
SMILESCCOc1ncccc1CNC(=O)CCc1c[nH]c2ccccc12
InChIInChI=1S/C19H21N3O2/c1-2-24-19-15(6-5-11-20-19)13-22-18(23)10-9-14-12-21-17-8-4-3-7-16(14)17/h3-8,11-12,21H,2,9-10,13H2,1H3,(H,22,23)
InChIKeyVOZBTUNPSAHPDG-UHFFFAOYSA-N
XLogP3.21
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide
CID 17473957
N-[(2-ethoxy-3-pyridinyl)methyl]-3-(4-fluorophenyl)propanamide
CID 37487522
N-[(2-bromophenyl)methyl]-3-(1H-indol-3-yl)propanamide
CID 70209057
N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide
CID 43591658
3-(1H-indol-3-yl)-N-(pyridin-3-ylmethyl)propanamide
CID 4806902
N-[(4-ethoxy-3-methoxyphenyl)methyl]-3-(1H-indol-3-yl)propanamide
CID 55659713
3-(4-tert-butylphenyl)-N-[(2-ethoxy-3-pyridinyl)methyl]propanamide
CID 37487440
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
3-(1,4-dioxo-3H-phthalazin-2-yl)-N-[(2-ethoxy-3-pyridinyl)methyl]propanamide
CID 37487509
N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-(1H-indol-3-yl)acetamide
CID 46463836
3-(1H-indol-3-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)propanamide
CID 60983559
3-(1H-indol-3-yl)-N-(1,3-thiazol-4-ylmethyl)propanamide
CID 49346210

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide?
The IUPAC name of N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide (CID 38537408) is N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide.
What is the SMILES notation for N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide?
The canonical SMILES for N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide is CCOc1ncccc1CNC(=O)CCc1c[nH]c2ccccc12.
What is the InChIKey of N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide?
The InChIKey is VOZBTUNPSAHPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-2-24-19-15(6-5-11-20-19)13-22-18(23)10-9-14-12-21-17-8-4-3-7-16(14)17/h3-8,11-12,21H,2,9-10,13H2,1H3,(H,22,23).
What are the key properties of N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide?
N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide has a molecular weight of 323.40 g/mol, XLogP of 3.21, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethoxy-3-pyridinyl)methyl]-3-(1H-indol-3-yl)propanamide is sourced from PubChem (CID 38537408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).