4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide

C10H14BrN3O2 — CID 103154268

IUPAC4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide
SMILESCOC(CN)CC(=O)Nc1ccc(Br)cn1
InChIInChI=1S/C10H14BrN3O2/c1-16-8(5-12)4-10(15)14-9-3-2-7(11)6-13-9/h2-3,6,8H,4-5,12H2,1H3,(H,13,14,15)
InChIKeyYVQFPSVRIZUFKO-UHFFFAOYSA-N
MW288.14 g/mol
LogP1.15
Rot. Bonds5

About 4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide

4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide (PubChem CID 103154268) has the molecular formula C10H14BrN3O2 and a molecular weight of 288.14 g/mol. Its IUPAC name is 4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide.

Molecular Properties

Compound Name4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide
PubChem CID103154268
Molecular FormulaC10H14BrN3O2
Molecular Weight288.14 g/mol
Exact Mass287.03
IUPAC Name4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide
SMILESCOC(CN)CC(=O)Nc1ccc(Br)cn1
InChIInChI=1S/C10H14BrN3O2/c1-16-8(5-12)4-10(15)14-9-3-2-7(11)6-13-9/h2-3,6,8H,4-5,12H2,1H3,(H,13,14,15)
InChIKeyYVQFPSVRIZUFKO-UHFFFAOYSA-N
XLogP1.15
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.14
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(5-bromo-2-pyridinyl)-3-ethoxybutanamide
CID 114227302
(3S)-3-amino-N-(5-bromo-2-pyridinyl)-4-hydroxybutanamide
CID 130348311
N-(5-bromo-2-pyridinyl)-2-ethoxyacetamide
CID 60655115
4-amino-3-methoxy-N-(5-methyl-1H-pyrazol-3-yl)butanamide
CID 103155915
methyl 3-[[2-[(5-bromo-2-pyridinyl)amino]-2-oxoethyl]-methylamino]-2-methylpropanoate
CID 62011505
4-amino-N-[1-(4-bromophenyl)ethyl]-3-methoxybutanamide;hydrochloride
CID 120590463
N-(5-bromo-2-pyridinyl)-2-methylpropanamide
CID 14988412
2-(4-bromophenyl)-N-(5-bromo-2-pyridinyl)acetamide
CID 29260244
4-amino-N-(4-hydroxyphenyl)-3-methoxybutanamide
CID 103154769
4-amino-3-methoxy-N-(3-methylphenyl)butanamide
CID 103154212
N-(5-bromo-2-pyridinyl)-3-phenoxypropanamide
CID 29260428
3-[2-[(5-bromo-2-pyridinyl)amino]-2-oxoethyl]sulfanylbutanoic acid
CID 66138511

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide?
The IUPAC name of 4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide (CID 103154268) is 4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide.
What is the SMILES notation for 4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide?
The canonical SMILES for 4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide is COC(CN)CC(=O)Nc1ccc(Br)cn1.
What is the InChIKey of 4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide?
The InChIKey is YVQFPSVRIZUFKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3O2/c1-16-8(5-12)4-10(15)14-9-3-2-7(11)6-13-9/h2-3,6,8H,4-5,12H2,1H3,(H,13,14,15).
What are the key properties of 4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide?
4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide has a molecular weight of 288.14 g/mol, XLogP of 1.15, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(5-bromo-2-pyridinyl)-3-methoxybutanamide is sourced from PubChem (CID 103154268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).