[1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone

C15H22F2N4O2 — CID 132971293

IUPAC[1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(Cc2nccn2C(F)F)CC1)N1CCOCC1
InChIInChI=1S/C15H22F2N4O2/c16-15(17)21-6-3-18-13(21)11-19-4-1-12(2-5-19)14(22)20-7-9-23-10-8-20/h3,6,12,15H,1-2,4-5,7-11H2
InChIKeyKYZYFENQJQRHHK-UHFFFAOYSA-N
MW328.36 g/mol
LogP1.35
Rot. Bonds4

About [1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone

[1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone (PubChem CID 132971293) has the molecular formula C15H22F2N4O2 and a molecular weight of 328.36 g/mol. Its IUPAC name is [1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone
PubChem CID132971293
Molecular FormulaC15H22F2N4O2
Molecular Weight328.36 g/mol
Exact Mass328.17
IUPAC Name[1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(Cc2nccn2C(F)F)CC1)N1CCOCC1
InChIInChI=1S/C15H22F2N4O2/c16-15(17)21-6-3-18-13(21)11-19-4-1-12(2-5-19)14(22)20-7-9-23-10-8-20/h3,6,12,15H,1-2,4-5,7-11H2
InChIKeyKYZYFENQJQRHHK-UHFFFAOYSA-N
XLogP1.35
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.36
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone 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

1-[3-(2-Methylimidazol-1-yl)piperidin-1-yl]-2-(2,2,2-trifluoroethoxy)ethanone
CID 53620398
1-(ethoxyacetyl)-4-(1-methyl-1H-imidazol-2-yl)piperidine
CID 70720685
4-{2-[4-(1-methyl-1H-imidazol-2-yl)-1-piperidinyl]ethyl}morpholine
CID 70756829
1-[3-(2-Ethylimidazol-1-yl)piperidin-1-yl]-2-(2,2,2-trifluoroethoxy)ethanone
CID 72044143
N,N-dimethyl-2-{2-[1-(4,4,4-trifluorobutanoyl)-4-piperidinyl]-1H-imidazol-1-yl}ethanamine
CID 72853722
1-(methoxyacetyl)-N-methyl-N-[3-(1-methyl-1H-imidazol-2-yl)propyl]-4-piperidinecarboxamide
CID 72880226
1-(cyclopropylcarbonyl)-N-(2-hydroxyethyl)-N-[(1-methyl-1H-imidazol-2-yl)methyl]-4-piperidinecarboxamide
CID 72926706
4-(1-methyl-1H-imidazol-2-yl)-1-[(2,2,3,3-tetrafluoropropoxy)acetyl]piperidine
CID 72935564
4-(Cyclopropylmethyl)-9-[(1-methylimidazol-2-yl)methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 97471417
2-Ethoxy-1-[4-(imidazol-1-ylmethyl)piperidin-1-yl]ethanone
CID 52992542
4,4,4-trifluoro-1-[(3R)-3-[(2-methylimidazol-1-yl)methyl]piperidin-1-yl]butan-1-one
CID 96578748
3-[1-(2,2-Difluoroethyl)imidazol-2-yl]-1-piperidin-1-ylpropan-1-one
CID 134220588

Frequently Asked Questions

What is the IUPAC name of [1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone (CID 132971293) is [1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone is O=C(C1CCN(Cc2nccn2C(F)F)CC1)N1CCOCC1.
What is the InChIKey of [1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is KYZYFENQJQRHHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22F2N4O2/c16-15(17)21-6-3-18-13(21)11-19-4-1-12(2-5-19)14(22)20-7-9-23-10-8-20/h3,6,12,15H,1-2,4-5,7-11H2.
What are the key properties of [1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone?
[1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 328.36 g/mol, XLogP of 1.35, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 132971293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).