2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide

C12H15N5O2 — CID 81082774

IUPAC2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)Nc1ccc(-n2ccnc2)nc1
InChIInChI=1S/C12H15N5O2/c1-19-7-10(13)12(18)16-9-2-3-11(15-6-9)17-5-4-14-8-17/h2-6,8,10H,7,13H2,1H3,(H,16,18)
InChIKeyNSUBJZVGBCTAEB-UHFFFAOYSA-N
MW261.29 g/mol
LogP0.18
Rot. Bonds5

About 2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide

2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide (PubChem CID 81082774) has the molecular formula C12H15N5O2 and a molecular weight of 261.29 g/mol. Its IUPAC name is 2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide.

Molecular Properties

Compound Name2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide
PubChem CID81082774
Molecular FormulaC12H15N5O2
Molecular Weight261.29 g/mol
Exact Mass261.12
IUPAC Name2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)Nc1ccc(-n2ccnc2)nc1
InChIInChI=1S/C12H15N5O2/c1-19-7-10(13)12(18)16-9-2-3-11(15-6-9)17-5-4-14-8-17/h2-6,8,10H,7,13H2,1H3,(H,16,18)
InChIKeyNSUBJZVGBCTAEB-UHFFFAOYSA-N
XLogP0.18
TPSA95.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.29
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-N-(3-imidazol-1-ylphenyl)-3-methoxypropanamide
CID 81083217
N-(6-imidazol-1-yl-3-pyridinyl)-2-methylpropanamide
CID 35437698
2-bromo-N-(6-imidazol-1-yl-3-pyridinyl)butanamide
CID 62855029
2-(aminomethyl)-N-(6-imidazol-1-yl-3-pyridinyl)pentanamide
CID 65225245
ethyl 2-[(6-imidazol-1-yl-3-pyridinyl)amino]-2-oxoacetate
CID 90564814
N-(6-imidazol-1-yl-3-pyridinyl)butanamide
CID 35437719
(2S)-2-[ethyl(methyl)amino]-N-(6-imidazol-1-yl-3-pyridinyl)-2-phenylacetamide
CID 95292032
(2R)-2-(carbamoylamino)-N-(6-imidazol-1-yl-3-pyridinyl)-4-methylsulfanylbutanamide
CID 95300199
2-(2-chlorophenoxy)-N-(6-imidazol-1-yl-3-pyridinyl)butanamide
CID 75424281
N-(6-imidazol-1-yl-3-pyridinyl)-4-(methylamino)butanamide;dihydrochloride
CID 119846827
2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide
CID 60867461
N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide
CID 90564820

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide?
The IUPAC name of 2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide (CID 81082774) is 2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide.
What is the SMILES notation for 2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide?
The canonical SMILES for 2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide is COCC(N)C(=O)Nc1ccc(-n2ccnc2)nc1.
What is the InChIKey of 2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide?
The InChIKey is NSUBJZVGBCTAEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O2/c1-19-7-10(13)12(18)16-9-2-3-11(15-6-9)17-5-4-14-8-17/h2-6,8,10H,7,13H2,1H3,(H,16,18).
What are the key properties of 2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide?
2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide has a molecular weight of 261.29 g/mol, XLogP of 0.18, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(6-imidazol-1-yl-3-pyridinyl)-3-methoxypropanamide is sourced from PubChem (CID 81082774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).