2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide

C15H21N5O — CID 114721807

IUPAC2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)C(C)n1cncc1-c1cnccc1N
InChIInChI=1S/C15H21N5O/c1-10(2)6-19-15(21)11(3)20-9-18-8-14(20)12-7-17-5-4-13(12)16/h4-5,7-11H,6H2,1-3H3,(H2,16,17)(H,19,21)
InChIKeyJDRBBQDDLOGLNT-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.86
Rot. Bonds5

About 2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide

2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide (PubChem CID 114721807) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide
PubChem CID114721807
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)C(C)n1cncc1-c1cnccc1N
InChIInChI=1S/C15H21N5O/c1-10(2)6-19-15(21)11(3)20-9-18-8-14(20)12-7-17-5-4-13(12)16/h4-5,7-11H,6H2,1-3H3,(H2,16,17)(H,19,21)
InChIKeyJDRBBQDDLOGLNT-UHFFFAOYSA-N
XLogP1.86
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N,N-diethylpropanamide
CID 114721819
2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-propan-2-ylacetamide
CID 114718031
3-amino-N-(2-methylpropyl)pyridine-4-carboxamide
CID 110848376
2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methoxyethyl)acetamide
CID 114722000
3-[3-(1-cyclohexylpropyl)imidazol-4-yl]pyridin-4-amine
CID 114720144
3-[3-[1-(2,5-dimethylthiophen-3-yl)ethyl]imidazol-4-yl]pyridin-4-amine
CID 114718489
2-[5-(2-amino-3-pyridinyl)imidazol-1-yl]-N,N-diethylpropanamide
CID 114721812
4-amino-1-[1-(2-methylpropylamino)-1-oxopropan-2-yl]pyrazole-3-carboxylic acid
CID 107344126
(2R)-2-amino-4-methyl-N-[(3-methyl-4-pyridinyl)methyl]pentanamide
CID 104941409
2-amino-4-methyl-N-(pyridin-4-ylmethyl)pentanamide
CID 43107780
3-[3-(2-pyrrolidin-1-ylpropyl)imidazol-4-yl]pyridin-4-amine
CID 114721375
ethyl 2-[5-(2-amino-4-pyridinyl)imidazol-1-yl]propanoate
CID 114718853

Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide?
The IUPAC name of 2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide (CID 114721807) is 2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide?
The canonical SMILES for 2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide is CC(C)CNC(=O)C(C)n1cncc1-c1cnccc1N.
What is the InChIKey of 2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide?
The InChIKey is JDRBBQDDLOGLNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-10(2)6-19-15(21)11(3)20-9-18-8-14(20)12-7-17-5-4-13(12)16/h4-5,7-11H,6H2,1-3H3,(H2,16,17)(H,19,21).
What are the key properties of 2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide?
2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide has a molecular weight of 287.37 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 114721807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).