2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide

C15H21N5O — CID 79813550

IUPAC2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide
SMILESCCC(N)(CC)C(=O)Nc1ccc(-n2ccnc2C)nc1
InChIInChI=1S/C15H21N5O/c1-4-15(16,5-2)14(21)19-12-6-7-13(18-10-12)20-9-8-17-11(20)3/h6-10H,4-5,16H2,1-3H3,(H,19,21)
InChIKeyYMEUZQFFZKDUFW-UHFFFAOYSA-N
MW287.37 g/mol
LogP2.03
Rot. Bonds5

About 2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide

2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide (PubChem CID 79813550) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide.

Molecular Properties

Compound Name2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide
PubChem CID79813550
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide
SMILESCCC(N)(CC)C(=O)Nc1ccc(-n2ccnc2C)nc1
InChIInChI=1S/C15H21N5O/c1-4-15(16,5-2)14(21)19-12-6-7-13(18-10-12)20-9-8-17-11(20)3/h6-10H,4-5,16H2,1-3H3,(H,19,21)
InChIKeyYMEUZQFFZKDUFW-UHFFFAOYSA-N
XLogP2.03
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 ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-6-(2-methylimidazol-1-yl)pyridin-3-amine
CID 43748706
3-amino-4-[[6-(2-methylimidazol-1-yl)-3-pyridinyl]amino]-4-oxobutanoic acid
CID 64896268
1-(4-chlorophenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea
CID 90565133
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-2,2-diphenylacetamide
CID 90565042
1-amino-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]cyclobutane-1-carboxamide
CID 81179873
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]pent-4-enamide
CID 90564944
2-(cyclopropylamino)-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 60842509
3,4,5-triethoxy-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]benzamide
CID 90564983
2-methoxy-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]benzamide;hydrochloride
CID 71691689
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-3-propan-2-yloxypropanamide
CID 87018905
5-methyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-1,2-oxazole-3-carboxamide
CID 90565097
4-amino-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]oxolane-3-carboxamide
CID 66240019

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide?
The IUPAC name of 2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide (CID 79813550) is 2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide.
What is the SMILES notation for 2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide?
The canonical SMILES for 2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide is CCC(N)(CC)C(=O)Nc1ccc(-n2ccnc2C)nc1.
What is the InChIKey of 2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide?
The InChIKey is YMEUZQFFZKDUFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-4-15(16,5-2)14(21)19-12-6-7-13(18-10-12)20-9-8-17-11(20)3/h6-10H,4-5,16H2,1-3H3,(H,19,21).
What are the key properties of 2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide?
2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide has a molecular weight of 287.37 g/mol, XLogP of 2.03, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide is sourced from PubChem (CID 79813550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).