N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide

C10H16N2O2 — CID 110688667

IUPACN-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide
SMILESCOCCNC(=O)CCn1cccc1
InChIInChI=1S/C10H16N2O2/c1-14-9-5-11-10(13)4-8-12-6-2-3-7-12/h2-3,6-7H,4-5,8-9H2,1H3,(H,11,13)
InChIKeyLOCJQPLTYXCQKJ-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.64
Rot. Bonds6

About N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide

N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide (PubChem CID 110688667) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide
PubChem CID110688667
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC NameN-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide
SMILESCOCCNC(=O)CCn1cccc1
InChIInChI=1S/C10H16N2O2/c1-14-9-5-11-10(13)4-8-12-6-2-3-7-12/h2-3,6-7H,4-5,8-9H2,1H3,(H,11,13)
InChIKeyLOCJQPLTYXCQKJ-UHFFFAOYSA-N
XLogP0.64
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methoxy-N-(2-pyrrol-1-ylethyl)acetamide
CID 103716164
N,N'-bis(2-methoxyethyl)hexanediamide
CID 2933923
N-(3-methoxypropyl)-2-pyrrol-1-ylacetamide
CID 63810814
4-oxo-N-(2-pyrrol-1-ylethyl)pentanamide
CID 103846233
N-(2-methoxyethyl)-3-(3-methylpyrazol-1-yl)propanamide
CID 19555927
3-(4-acetylpiperazin-1-yl)-N-(2-methoxyethyl)propanamide
CID 109014994
5-methoxy-N-(2-methoxyethyl)pentanamide
CID 58281484
N-(2-methoxyethyl)-3-(methylamino)propanamide
CID 43827811
N-(2-hydroxy-3-methoxypropyl)-4-pyrrol-1-ylbutanamide
CID 109408533
N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide
CID 115590611
N-(2-methoxyethyl)-3-(5-methylpyrazol-1-yl)propanamide
CID 19569997
3-amino-N-[2-(2-methoxyethylamino)-2-oxoethyl]propanamide
CID 115733671

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide?
The IUPAC name of N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide (CID 110688667) is N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide.
What is the SMILES notation for N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide?
The canonical SMILES for N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide is COCCNC(=O)CCn1cccc1.
What is the InChIKey of N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide?
The InChIKey is LOCJQPLTYXCQKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-14-9-5-11-10(13)4-8-12-6-2-3-7-12/h2-3,6-7H,4-5,8-9H2,1H3,(H,11,13).
What are the key properties of N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide?
N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide has a molecular weight of 196.25 g/mol, XLogP of 0.64, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-pyrrol-1-ylpropanamide is sourced from PubChem (CID 110688667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).