2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide

C14H23N3O3 — CID 60853381

IUPAC2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide
SMILESCCC(C)NCC(=O)Nc1ccc(OCCOC)nc1
InChIInChI=1S/C14H23N3O3/c1-4-11(2)15-10-13(18)17-12-5-6-14(16-9-12)20-8-7-19-3/h5-6,9,11,15H,4,7-8,10H2,1-3H3,(H,17,18)
InChIKeyLTJCHGZLWDVLIT-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.43
Rot. Bonds9

About 2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide

2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide (PubChem CID 60853381) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide
PubChem CID60853381
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide
SMILESCCC(C)NCC(=O)Nc1ccc(OCCOC)nc1
InChIInChI=1S/C14H23N3O3/c1-4-11(2)15-10-13(18)17-12-5-6-14(16-9-12)20-8-7-19-3/h5-6,9,11,15H,4,7-8,10H2,1-3H3,(H,17,18)
InChIKeyLTJCHGZLWDVLIT-UHFFFAOYSA-N
XLogP1.43
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.43
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-[6-(2-methoxyethoxy)-3-pyridinyl]-2-(methylamino)acetamide
CID 43704151
(2S,3S)-2-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-methylpentanamide
CID 61178172
2-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]propanamide
CID 43704147
3-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide
CID 62668693
5-chloro-N-[6-(2-methoxyethoxy)-3-pyridinyl]pentanamide
CID 43697910
2-[[(2S)-butan-2-yl]amino]-N-(4-fluorophenyl)acetamide
CID 28565900
2-[2-[[6-(2-methoxyethoxy)-3-pyridinyl]amino]-2-oxoethyl]sulfanylacetic acid
CID 104569275
N-[6-(2-methoxyethoxy)-3-pyridinyl]-4-(methylamino)butanamide
CID 54924715
6-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]hexanamide
CID 43704143
2-bromo-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide
CID 100773616
N-(4-fluorophenyl)-2-(1-methoxypropan-2-ylamino)acetamide
CID 43179600
1-[6-(2-methoxyethoxy)-3-pyridinyl]-3-[(2R)-1-pyrrolidin-1-ylbutan-2-yl]urea
CID 95772217

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide (CID 60853381) is 2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide is CCC(C)NCC(=O)Nc1ccc(OCCOC)nc1.
What is the InChIKey of 2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide?
The InChIKey is LTJCHGZLWDVLIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-4-11(2)15-10-13(18)17-12-5-6-14(16-9-12)20-8-7-19-3/h5-6,9,11,15H,4,7-8,10H2,1-3H3,(H,17,18).
What are the key properties of 2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide?
2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide has a molecular weight of 281.36 g/mol, XLogP of 1.43, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-[6-(2-methoxyethoxy)-3-pyridinyl]acetamide is sourced from PubChem (CID 60853381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).