N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide

C22H28N2O3 — CID 3152021

IUPACN-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide
SMILESO=C(c1ccc(NC(=O)C23CC4CC(CC(C4)C2)C3)cc1)N1CCOCC1
InChIInChI=1S/C22H28N2O3/c25-20(24-5-7-27-8-6-24)18-1-3-19(4-2-18)23-21(26)22-12-15-9-16(13-22)11-17(10-15)14-22/h1-4,15-17H,5-14H2,(H,23,26)
InChIKeyJNHLPEOPIOOOPA-UHFFFAOYSA-N
MW368.48 g/mol
LogP3.31
Rot. Bonds3

About N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide

N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide (PubChem CID 3152021) has the molecular formula C22H28N2O3 and a molecular weight of 368.48 g/mol. Its IUPAC name is N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide.

Molecular Properties

Compound NameN-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide
PubChem CID3152021
Molecular FormulaC22H28N2O3
Molecular Weight368.48 g/mol
Exact Mass368.21
IUPAC NameN-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide
SMILESO=C(c1ccc(NC(=O)C23CC4CC(CC(C4)C2)C3)cc1)N1CCOCC1
InChIInChI=1S/C22H28N2O3/c25-20(24-5-7-27-8-6-24)18-1-3-19(4-2-18)23-21(26)22-12-15-9-16(13-22)11-17(10-15)14-22/h1-4,15-17H,5-14H2,(H,23,26)
InChIKeyJNHLPEOPIOOOPA-UHFFFAOYSA-N
XLogP3.31
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[4-(morpholine-4-carbonyl)phenyl]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-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]adamantane-1-carboxamide
CID 110352818
N-(4-morpholin-4-ylsulfonylphenyl)adamantane-1-carboxamide
CID 3585715
2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide
CID 78892227
4-[[(3S,6R)-tricyclo[4.3.1.13,8]undecane-1-carbonyl]amino]benzoic acid
CID 6990096
N-(4-formamidophenyl)adamantane-1-carboxamide
CID 168653489
3-hydroxy-N-(4-morpholin-4-ylphenyl)adamantane-1-carboxamide
CID 4835232
N-[3-(2-methylmorpholine-4-carbonyl)phenyl]adamantane-1-carboxamide
CID 110352983
N-[3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]adamantane-1-carboxamide
CID 16762834
N-(2,3-dihydro-1,4-benzodioxin-6-yl)adamantane-1-carboxamide
CID 2862065
N-(4-formylphenyl)adamantane-1-carboxamide
CID 106912217
N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide
CID 653867
trans-(1S,2S)-2-[[4-(morpholine-4-carbonyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 1080146

Frequently Asked Questions

What is the IUPAC name of N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide?
The IUPAC name of N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide (CID 3152021) is N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide.
What is the SMILES notation for N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide?
The canonical SMILES for N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide is O=C(c1ccc(NC(=O)C23CC4CC(CC(C4)C2)C3)cc1)N1CCOCC1.
What is the InChIKey of N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide?
The InChIKey is JNHLPEOPIOOOPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O3/c25-20(24-5-7-27-8-6-24)18-1-3-19(4-2-18)23-21(26)22-12-15-9-16(13-22)11-17(10-15)14-22/h1-4,15-17H,5-14H2,(H,23,26).
What are the key properties of N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide?
N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide has a molecular weight of 368.48 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide is sourced from PubChem (CID 3152021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).