4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide

C17H24N4O2 — CID 71925660

IUPAC4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide
SMILESCc1ccc(C2CC(C)CCN2C(=O)NCc2nccn2C)o1
InChIInChI=1S/C17H24N4O2/c1-12-6-8-21(14(10-12)15-5-4-13(2)23-15)17(22)19-11-16-18-7-9-20(16)3/h4-5,7,9,12,14H,6,8,10-11H2,1-3H3,(H,19,22)
InChIKeyKHMQLNQRQMRSGF-UHFFFAOYSA-N
MW316.41 g/mol
LogP3.00
Rot. Bonds3

About 4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide

4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide (PubChem CID 71925660) has the molecular formula C17H24N4O2 and a molecular weight of 316.41 g/mol. Its IUPAC name is 4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide
PubChem CID71925660
Molecular FormulaC17H24N4O2
Molecular Weight316.41 g/mol
Exact Mass316.19
IUPAC Name4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide
SMILESCc1ccc(C2CC(C)CCN2C(=O)NCc2nccn2C)o1
InChIInChI=1S/C17H24N4O2/c1-12-6-8-21(14(10-12)15-5-4-13(2)23-15)17(22)19-11-16-18-7-9-20(16)3/h4-5,7,9,12,14H,6,8,10-11H2,1-3H3,(H,19,22)
InChIKeyKHMQLNQRQMRSGF-UHFFFAOYSA-N
XLogP3.00
TPSA63.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]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

Related Compounds

4-methyl-2-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide
CID 71989175
(2S,4S)-4-methyl-2-(5-methylfuran-2-yl)-N-(1,2-oxazol-3-yl)piperidine-1-carboxamide
CID 99586706
4-methyl-2-(5-methylfuran-2-yl)-N-(1,2-oxazol-3-yl)piperidine-1-carboxamide
CID 86799946
(2R,4S)-N-(3-fluoro-4-pyridinyl)-4-methyl-2-(5-methylfuran-2-yl)piperidine-1-carboxamide
CID 99584247
N-[3-[(2R,4R)-4-methyl-2-(5-methylfuran-2-yl)piperidin-1-yl]-3-oxopropyl]prop-2-enamide
CID 166411128
(1-methylimidazol-2-yl)methylcarbamic acid
CID 89157603
1-[2-(5-ethylfuran-2-yl)-4-methylpiperidin-1-yl]-2-imidazol-1-ylpropan-1-one
CID 71993139
3-[1-[(1-methylimidazol-2-yl)methylcarbamoyl]piperidin-3-yl]propanoic acid
CID 63294450
2-[(1-methylimidazol-2-yl)methylamino]-2-oxoacetic acid
CID 63292500
N-[(1-methylimidazol-2-yl)methyl]imidazole-1-carboxamide
CID 63295768
(2R,3aS,6aS)-4-[(5-methylfuran-2-yl)methyl]-N-[(1-methylimidazol-2-yl)methyl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrole-2-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 171685842
(2S,3aR,6aR)-4-[(5-methylfuran-2-yl)methyl]-N-[(1-methylimidazol-2-yl)methyl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrole-2-carboxamide;2,2,2-trifluoroacetic acid
CID 155829090

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide?
The IUPAC name of 4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide (CID 71925660) is 4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide?
The canonical SMILES for 4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide is Cc1ccc(C2CC(C)CCN2C(=O)NCc2nccn2C)o1.
What is the InChIKey of 4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide?
The InChIKey is KHMQLNQRQMRSGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-12-6-8-21(14(10-12)15-5-4-13(2)23-15)17(22)19-11-16-18-7-9-20(16)3/h4-5,7,9,12,14H,6,8,10-11H2,1-3H3,(H,19,22).
What are the key properties of 4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide?
4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide has a molecular weight of 316.41 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(5-methylfuran-2-yl)-N-[(1-methylimidazol-2-yl)methyl]piperidine-1-carboxamide is sourced from PubChem (CID 71925660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).