N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide

C16H19FN4O2 — CID 46958737

IUPACN-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide
SMILESCn1ccnc1C1(O)CCN(C(=O)Nc2ccc(F)cc2)CC1
InChIInChI=1S/C16H19FN4O2/c1-20-11-8-18-14(20)16(23)6-9-21(10-7-16)15(22)19-13-4-2-12(17)3-5-13/h2-5,8,11,23H,6-7,9-10H2,1H3,(H,19,22)
InChIKeyYTZMKEJTLCVISV-UHFFFAOYSA-N
MW318.35 g/mol
LogP2.07
Rot. Bonds2

About N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide

N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide (PubChem CID 46958737) has the molecular formula C16H19FN4O2 and a molecular weight of 318.35 g/mol. Its IUPAC name is N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide
PubChem CID46958737
Molecular FormulaC16H19FN4O2
Molecular Weight318.35 g/mol
Exact Mass318.15
IUPAC NameN-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide
SMILESCn1ccnc1C1(O)CCN(C(=O)Nc2ccc(F)cc2)CC1
InChIInChI=1S/C16H19FN4O2/c1-20-11-8-18-14(20)16(23)6-9-21(10-7-16)15(22)19-13-4-2-12(17)3-5-13/h2-5,8,11,23H,6-7,9-10H2,1H3,(H,19,22)
InChIKeyYTZMKEJTLCVISV-UHFFFAOYSA-N
XLogP2.07
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.35
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide (CID 46958737) is N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide is Cn1ccnc1C1(O)CCN(C(=O)Nc2ccc(F)cc2)CC1.
What is the InChIKey of N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide?
The InChIKey is YTZMKEJTLCVISV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN4O2/c1-20-11-8-18-14(20)16(23)6-9-21(10-7-16)15(22)19-13-4-2-12(17)3-5-13/h2-5,8,11,23H,6-7,9-10H2,1H3,(H,19,22).
What are the key properties of N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide?
N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide has a molecular weight of 318.35 g/mol, XLogP of 2.07, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-4-hydroxy-4-(1-methylimidazol-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 46958737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).