N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine

C19H30N4O — CID 16676901

IUPACN-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine
SMILESCc1ccc(CN(Cc2cnc[nH]2)C2CC(C)(C)NC(C)(C)C2)o1
InChIInChI=1S/C19H30N4O/c1-14-6-7-17(24-14)12-23(11-15-10-20-13-21-15)16-8-18(2,3)22-19(4,5)9-16/h6-7,10,13,16,22H,8-9,11-12H2,1-5H3,(H,20,21)
InChIKeyMJUOWHFFHDWKFN-UHFFFAOYSA-N
MW330.48 g/mol
LogP3.62
Rot. Bonds5

About N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine

N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine (PubChem CID 16676901) has the molecular formula C19H30N4O and a molecular weight of 330.48 g/mol. Its IUPAC name is N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine.

Molecular Properties

Compound NameN-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine
PubChem CID16676901
Molecular FormulaC19H30N4O
Molecular Weight330.48 g/mol
Exact Mass330.24
IUPAC NameN-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine
SMILESCc1ccc(CN(Cc2cnc[nH]2)C2CC(C)(C)NC(C)(C)C2)o1
InChIInChI=1S/C19H30N4O/c1-14-6-7-17(24-14)12-23(11-15-10-20-13-21-15)16-8-18(2,3)22-19(4,5)9-16/h6-7,10,13,16,22H,8-9,11-12H2,1-5H3,(H,20,21)
InChIKeyMJUOWHFFHDWKFN-UHFFFAOYSA-N
XLogP3.62
TPSA57.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.48
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine 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-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine?
The IUPAC name of N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine (CID 16676901) is N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine.
What is the SMILES notation for N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine?
The canonical SMILES for N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine is Cc1ccc(CN(Cc2cnc[nH]2)C2CC(C)(C)NC(C)(C)C2)o1.
What is the InChIKey of N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine?
The InChIKey is MJUOWHFFHDWKFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O/c1-14-6-7-17(24-14)12-23(11-15-10-20-13-21-15)16-8-18(2,3)22-19(4,5)9-16/h6-7,10,13,16,22H,8-9,11-12H2,1-5H3,(H,20,21).
What are the key properties of N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine?
N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine has a molecular weight of 330.48 g/mol, XLogP of 3.62, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethyl-N-[(5-methylfuran-2-yl)methyl]piperidin-4-amine is sourced from PubChem (CID 16676901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).