N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide

C24H24N2O2 — CID 46468266

IUPACN-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide
SMILESCC(NC(=O)Cc1ccc2ccccc2c1)c1ccc(NC(=O)C2CC2)cc1
InChIInChI=1S/C24H24N2O2/c1-16(18-10-12-22(13-11-18)26-24(28)20-8-9-20)25-23(27)15-17-6-7-19-4-2-3-5-21(19)14-17/h2-7,10-14,16,20H,8-9,15H2,1H3,(H,25,27)(H,26,28)
InChIKeyIUYNXSNPKZMZHJ-UHFFFAOYSA-N
MW372.47 g/mol
LogP4.61
Rot. Bonds6

About N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide

N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide (PubChem CID 46468266) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide
PubChem CID46468266
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC NameN-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide
SMILESCC(NC(=O)Cc1ccc2ccccc2c1)c1ccc(NC(=O)C2CC2)cc1
InChIInChI=1S/C24H24N2O2/c1-16(18-10-12-22(13-11-18)26-24(28)20-8-9-20)25-23(27)15-17-6-7-19-4-2-3-5-21(19)14-17/h2-7,10-14,16,20H,8-9,15H2,1H3,(H,25,27)(H,26,28)
InChIKeyIUYNXSNPKZMZHJ-UHFFFAOYSA-N
XLogP4.61
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide (CID 46468266) is N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide is CC(NC(=O)Cc1ccc2ccccc2c1)c1ccc(NC(=O)C2CC2)cc1.
What is the InChIKey of N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide?
The InChIKey is IUYNXSNPKZMZHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2/c1-16(18-10-12-22(13-11-18)26-24(28)20-8-9-20)25-23(27)15-17-6-7-19-4-2-3-5-21(19)14-17/h2-7,10-14,16,20H,8-9,15H2,1H3,(H,25,27)(H,26,28).
What are the key properties of N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide?
N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide has a molecular weight of 372.47 g/mol, XLogP of 4.61, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-[(2-naphthalen-2-ylacetyl)amino]ethyl]phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 46468266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).