ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone

C11H19N3O — CID 142344786

IUPACethane;1H-imidazol-5-yl(piperidin-1-yl)methanone
SMILESCC.O=C(c1cnc[nH]1)N1CCCCC1
InChIInChI=1S/C9H13N3O.C2H6/c13-9(8-6-10-7-11-8)12-4-2-1-3-5-12;1-2/h6-7H,1-5H2,(H,10,11);1-2H3
InChIKeyZMLXGSSRQNKNBA-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.06
Rot. Bonds1

About ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone

ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone (PubChem CID 142344786) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone.

Molecular Properties

Compound Nameethane;1H-imidazol-5-yl(piperidin-1-yl)methanone
PubChem CID142344786
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Nameethane;1H-imidazol-5-yl(piperidin-1-yl)methanone
SMILESCC.O=C(c1cnc[nH]1)N1CCCCC1
InChIInChI=1S/C9H13N3O.C2H6/c13-9(8-6-10-7-11-8)12-4-2-1-3-5-12;1-2/h6-7H,1-5H2,(H,10,11);1-2H3
InChIKeyZMLXGSSRQNKNBA-UHFFFAOYSA-N
XLogP2.06
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone 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

fluorobenzene;1H-imidazol-5-yl(pyrrolidin-1-yl)methanone
CID 167484753
1H-imidazol-5-yl-[(3R)-3-methylpyrrolidin-1-yl]methanone
CID 89293635
1H-imidazol-5-yl-[(3R)-3-(methylsulfanylmethyl)piperidin-1-yl]methanone
CID 125144377
1H-imidazol-5-yl-[(3S)-3-(methylsulfanylmethyl)piperidin-1-yl]methanone
CID 125144378
[(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone
CID 129371649
[(3R)-1-(1H-imidazole-5-carbonyl)piperidin-3-yl]-(4-phenylphenyl)methanone
CID 42454203
1H-imidazol-5-yl-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methanone
CID 164689152
1-(1H-imidazole-5-carbonyl)piperidine-3,4-dicarboxylic acid
CID 112568032
1H-imidazol-5-yl-[4-methyl-4-(1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 110114185
1H-imidazol-5-yl-[4-[(6-methylpyrimidin-4-yl)amino]piperidin-1-yl]methanone
CID 126887552
[4-[4-(cyclohexylmethyl)triazol-1-yl]piperidin-1-yl]-(1H-imidazol-5-yl)methanone
CID 30881980
1H-imidazole-5-carboxylic acid;dihydrate
CID 140542846

Frequently Asked Questions

What is the IUPAC name of ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone?
The IUPAC name of ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone (CID 142344786) is ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone.
What is the SMILES notation for ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone?
The canonical SMILES for ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone is CC.O=C(c1cnc[nH]1)N1CCCCC1.
What is the InChIKey of ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone?
The InChIKey is ZMLXGSSRQNKNBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O.C2H6/c13-9(8-6-10-7-11-8)12-4-2-1-3-5-12;1-2/h6-7H,1-5H2,(H,10,11);1-2H3.
What are the key properties of ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone?
ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone has a molecular weight of 209.29 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone is sourced from PubChem (CID 142344786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).