N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide

C22H32N2O2 — CID 4880413

IUPACN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide
SMILESO=C(NCC(c1ccco1)N1CCCCC1)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C22H32N2O2/c25-21(22-12-16-9-17(13-22)11-18(10-16)14-22)23-15-19(20-5-4-8-26-20)24-6-2-1-3-7-24/h4-5,8,16-19H,1-3,6-7,9-15H2,(H,23,25)
InChIKeyGWJJYYGWDIFVDD-UHFFFAOYSA-N
MW356.51 g/mol
LogP4.14
Rot. Bonds5

About N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide

N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide (PubChem CID 4880413) has the molecular formula C22H32N2O2 and a molecular weight of 356.51 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide
PubChem CID4880413
Molecular FormulaC22H32N2O2
Molecular Weight356.51 g/mol
Exact Mass356.25
IUPAC NameN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide
SMILESO=C(NCC(c1ccco1)N1CCCCC1)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C22H32N2O2/c25-21(22-12-16-9-17(13-22)11-18(10-16)14-22)23-15-19(20-5-4-8-26-20)24-6-2-1-3-7-24/h4-5,8,16-19H,1-3,6-7,9-15H2,(H,23,25)
InChIKeyGWJJYYGWDIFVDD-UHFFFAOYSA-N
XLogP4.14
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.51
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-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

N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]adamantane-1-carboxamide
CID 40752691
N-[2-(azepan-1-yl)-2-thiophen-2-ylethyl]adamantane-1-carboxamide
CID 17012416
N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)adamantane-1-carboxamide
CID 17014187
1-amino-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclobutane-1-carboxamide
CID 81172062
1-amino-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentane-1-carboxamide
CID 61250554
N-[(2S)-2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]adamantane-1-carboxamide
CID 35126632
2,2-dichloro-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-1-methylcyclopropane-1-carboxamide
CID 51162655
N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopropanecarboxamide
CID 7780302
1-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-3-[(1-hydroxycyclobutyl)methyl]urea
CID 71930287
N-[2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]adamantane-1-carboxamide
CID 43842812
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430213
N-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]butanamide
CID 112503325

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide (CID 4880413) is N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide is O=C(NCC(c1ccco1)N1CCCCC1)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide?
The InChIKey is GWJJYYGWDIFVDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N2O2/c25-21(22-12-16-9-17(13-22)11-18(10-16)14-22)23-15-19(20-5-4-8-26-20)24-6-2-1-3-7-24/h4-5,8,16-19H,1-3,6-7,9-15H2,(H,23,25).
What are the key properties of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide?
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide has a molecular weight of 356.51 g/mol, XLogP of 4.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]adamantane-1-carboxamide is sourced from PubChem (CID 4880413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).