N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide

C24H20NOP — CID 57324512

IUPACN-(6-diphenylphosphanylnaphthalen-1-yl)acetamide
SMILESCC(=O)Nc1cccc2cc(P(c3ccccc3)c3ccccc3)ccc12
InChIInChI=1S/C24H20NOP/c1-18(26)25-24-14-8-9-19-17-22(15-16-23(19)24)27(20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-17H,1H3,(H,25,26)
InChIKeyUXSHSHVHHDNJNH-UHFFFAOYSA-N
MW369.40 g/mol
LogP4.56
Rot. Bonds4

About N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide

N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide (PubChem CID 57324512) has the molecular formula C24H20NOP and a molecular weight of 369.40 g/mol. Its IUPAC name is N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide.

Molecular Properties

Compound NameN-(6-diphenylphosphanylnaphthalen-1-yl)acetamide
PubChem CID57324512
Molecular FormulaC24H20NOP
Molecular Weight369.40 g/mol
Exact Mass369.13
IUPAC NameN-(6-diphenylphosphanylnaphthalen-1-yl)acetamide
SMILESCC(=O)Nc1cccc2cc(P(c3ccccc3)c3ccccc3)ccc12
InChIInChI=1S/C24H20NOP/c1-18(26)25-24-14-8-9-19-17-22(15-16-23(19)24)27(20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-17H,1H3,(H,25,26)
InChIKeyUXSHSHVHHDNJNH-UHFFFAOYSA-N
XLogP4.56
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.40
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

2-(5-acetamidonaphthalen-2-yl)-4-methoxybenzoic acid
CID 154189489
acetic acid;triphenylphosphane;hydrochloride
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propan-2-one;triphenylphosphane;hydrate
CID 118484852
N-(2-benzofuran-4-yl)acetamide
CID 174465432
copper(1+);bis(triphenylphosphane);acetate
CID 175797724
palladium(2+);triphenylphosphane;diacetate
CID 11554889
copper(1+);tris(triphenylphosphane);acetate
CID 56954258
1-(3-diphenylphosphanylphenyl)-3-phenylurea
CID 71413565
N-(7-phenylmethoxynaphthalen-1-yl)acetamide
CID 91699937
acetic acid;chlororuthenium;tris(triphenylphosphane)
CID 172641403
1-naphthalen-1-yl-3-[2-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 177491059
N,N'-dinaphthalen-1-ylbutanediamide
CID 1346643

Frequently Asked Questions

What is the IUPAC name of N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide?
The IUPAC name of N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide (CID 57324512) is N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide.
What is the SMILES notation for N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide?
The canonical SMILES for N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide is CC(=O)Nc1cccc2cc(P(c3ccccc3)c3ccccc3)ccc12.
What is the InChIKey of N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide?
The InChIKey is UXSHSHVHHDNJNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20NOP/c1-18(26)25-24-14-8-9-19-17-22(15-16-23(19)24)27(20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-17H,1H3,(H,25,26).
What are the key properties of N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide?
N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide has a molecular weight of 369.40 g/mol, XLogP of 4.56, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-diphenylphosphanylnaphthalen-1-yl)acetamide is sourced from PubChem (CID 57324512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).