N-phenylacetamide;2-phenyladamantane

C24H29NO — CID 175533998

IUPACN-phenylacetamide;2-phenyladamantane
SMILESCC(=O)Nc1ccccc1.c1ccc(C2C3CC4CC(C3)CC2C4)cc1
InChIInChI=1S/C16H20.C8H9NO/c1-2-4-13(5-3-1)16-14-7-11-6-12(9-14)10-15(16)8-11;1-7(10)9-8-5-3-2-4-6-8/h1-5,11-12,14-16H,6-10H2;2-6H,1H3,(H,9,10)
InChIKeyNWWRNZPBKDSJBZ-UHFFFAOYSA-N
MW347.50 g/mol
LogP5.87
Rot. Bonds2

About N-phenylacetamide;2-phenyladamantane

N-phenylacetamide;2-phenyladamantane (PubChem CID 175533998) has the molecular formula C24H29NO and a molecular weight of 347.50 g/mol. Its IUPAC name is N-phenylacetamide;2-phenyladamantane.

Molecular Properties

Compound NameN-phenylacetamide;2-phenyladamantane
PubChem CID175533998
Molecular FormulaC24H29NO
Molecular Weight347.50 g/mol
Exact Mass347.22
IUPAC NameN-phenylacetamide;2-phenyladamantane
SMILESCC(=O)Nc1ccccc1.c1ccc(C2C3CC4CC(C3)CC2C4)cc1
InChIInChI=1S/C16H20.C8H9NO/c1-2-4-13(5-3-1)16-14-7-11-6-12(9-14)10-15(16)8-11;1-7(10)9-8-5-3-2-4-6-8/h1-5,11-12,14-16H,6-10H2;2-6H,1H3,(H,9,10)
InChIKeyNWWRNZPBKDSJBZ-UHFFFAOYSA-N
XLogP5.87
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.50
LogP ≤ 55.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-[[4-(2-adamantyl)phenyl]sulfamoyl]phenyl]acetamide
CID 126178402
N-[4-(2-adamantyl)phenyl]-3-phenylpropanamide
CID 126178143
cobalt;N-phenylacetamide
CID 158689050
cis-(1R,2S)-N-(4-acetamidophenyl)-2-phenylcyclopropane-1-carboxamide
CID 7071046
acetyl bromide;N-phenylacetamide
CID 175285562
1-(4-phenyl-1-adamantyl)ethanone
CID 134195277
N-phenylacetamide;toluene
CID 175205531
deuteriomethane;ethane;N-phenylacetamide
CID 91156750
nitrous acid;N-phenylacetamide
CID 174797407
N-(4-hydroxyphenyl)acetamide;N-phenylacetamide
CID 174809741
acetohydrazide;N-phenylacetamide;hydrate
CID 174786539
2,4-bis(4-acetamidophenyl)cyclobutane-1,3-dicarboxylic acid
CID 90464818

Frequently Asked Questions

What is the IUPAC name of N-phenylacetamide;2-phenyladamantane?
The IUPAC name of N-phenylacetamide;2-phenyladamantane (CID 175533998) is N-phenylacetamide;2-phenyladamantane.
What is the SMILES notation for N-phenylacetamide;2-phenyladamantane?
The canonical SMILES for N-phenylacetamide;2-phenyladamantane is CC(=O)Nc1ccccc1.c1ccc(C2C3CC4CC(C3)CC2C4)cc1.
What is the InChIKey of N-phenylacetamide;2-phenyladamantane?
The InChIKey is NWWRNZPBKDSJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20.C8H9NO/c1-2-4-13(5-3-1)16-14-7-11-6-12(9-14)10-15(16)8-11;1-7(10)9-8-5-3-2-4-6-8/h1-5,11-12,14-16H,6-10H2;2-6H,1H3,(H,9,10).
What are the key properties of N-phenylacetamide;2-phenyladamantane?
N-phenylacetamide;2-phenyladamantane has a molecular weight of 347.50 g/mol, XLogP of 5.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenylacetamide;2-phenyladamantane is sourced from PubChem (CID 175533998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).