(2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide

C14H21N3O4 — CID 97352364

IUPAC(2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide
SMILESCCOCCO[C@H](C)C(=O)Nc1ncccc1NC(C)=O
InChIInChI=1S/C14H21N3O4/c1-4-20-8-9-21-10(2)14(19)17-13-12(16-11(3)18)6-5-7-15-13/h5-7,10H,4,8-9H2,1-3H3,(H,16,18)(H,15,17,19)/t10-/m1/s1
InChIKeyCQRGFDKRVQNQQP-SNVBAGLBSA-N
MW295.34 g/mol
LogP1.42
Rot. Bonds8

About (2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide

(2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide (PubChem CID 97352364) has the molecular formula C14H21N3O4 and a molecular weight of 295.34 g/mol. Its IUPAC name is (2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide
PubChem CID97352364
Molecular FormulaC14H21N3O4
Molecular Weight295.34 g/mol
Exact Mass295.15
IUPAC Name(2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide
SMILESCCOCCO[C@H](C)C(=O)Nc1ncccc1NC(C)=O
InChIInChI=1S/C14H21N3O4/c1-4-20-8-9-21-10(2)14(19)17-13-12(16-11(3)18)6-5-7-15-13/h5-7,10H,4,8-9H2,1-3H3,(H,16,18)(H,15,17,19)/t10-/m1/s1
InChIKeyCQRGFDKRVQNQQP-SNVBAGLBSA-N
XLogP1.42
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-tert-butylphenyl)-2-(2-ethoxyethoxy)propanamide
CID 60546063
2-(2-ethoxyethoxy)-N-[4-(methylcarbamoylamino)phenyl]propanamide
CID 47078303
N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide
CID 60546289
2-(2-ethoxyethoxy)-N-[3-(2-methylpyrimidin-4-yl)phenyl]propanamide
CID 47066335
(2S)-2-(2-ethoxyethoxy)-N-(4-imidazol-1-ylphenyl)propanamide
CID 94678339
N-(2-amino-5-methoxyphenyl)-2-(2-ethoxyethoxy)propanamide
CID 119421324
N-(2-aminophenyl)-2-(2-butoxyethoxy)propanamide
CID 43127114
2-(2-ethoxyethoxy)-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide
CID 47066278
N-(2-cyanophenyl)-2-(2-propoxyethoxy)propanamide
CID 63686205
(2R)-2-(2-ethoxyethoxy)-N-[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]propanamide
CID 94823273
2-(2-methylbutanoylamino)pyridine-3-carboxylic acid
CID 63654439
N-(4-amino-2,6-dichlorophenyl)-2-(2-ethoxyethoxy)propanamide
CID 43093302

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide?
The IUPAC name of (2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide (CID 97352364) is (2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide.
What is the SMILES notation for (2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide?
The canonical SMILES for (2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide is CCOCCO[C@H](C)C(=O)Nc1ncccc1NC(C)=O.
What is the InChIKey of (2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide?
The InChIKey is CQRGFDKRVQNQQP-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H21N3O4/c1-4-20-8-9-21-10(2)14(19)17-13-12(16-11(3)18)6-5-7-15-13/h5-7,10H,4,8-9H2,1-3H3,(H,16,18)(H,15,17,19)/t10-/m1/s1.
What are the key properties of (2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide?
(2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide has a molecular weight of 295.34 g/mol, XLogP of 1.42, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-acetamido-2-pyridinyl)-2-(2-ethoxyethoxy)propanamide is sourced from PubChem (CID 97352364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).