N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide

C23H25N3O — CID 9100114

IUPACN-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide
SMILESO=C(CNc1ccccc1N1CCCCC1)Nc1ccc2ccccc2c1
InChIInChI=1S/C23H25N3O/c27-23(25-20-13-12-18-8-2-3-9-19(18)16-20)17-24-21-10-4-5-11-22(21)26-14-6-1-7-15-26/h2-5,8-13,16,24H,1,6-7,14-15,17H2,(H,25,27)
InChIKeyKBKVWSAPJFKTIB-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.88
Rot. Bonds5

About N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide

N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide (PubChem CID 9100114) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide.

Molecular Properties

Compound NameN-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide
PubChem CID9100114
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC NameN-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide
SMILESO=C(CNc1ccccc1N1CCCCC1)Nc1ccc2ccccc2c1
InChIInChI=1S/C23H25N3O/c27-23(25-20-13-12-18-8-2-3-9-19(18)16-20)17-24-21-10-4-5-11-22(21)26-14-6-1-7-15-26/h2-5,8-13,16,24H,1,6-7,14-15,17H2,(H,25,27)
InChIKeyKBKVWSAPJFKTIB-UHFFFAOYSA-N
XLogP4.88
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide?
The IUPAC name of N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide (CID 9100114) is N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide.
What is the SMILES notation for N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide?
The canonical SMILES for N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide is O=C(CNc1ccccc1N1CCCCC1)Nc1ccc2ccccc2c1.
What is the InChIKey of N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide?
The InChIKey is KBKVWSAPJFKTIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c27-23(25-20-13-12-18-8-2-3-9-19(18)16-20)17-24-21-10-4-5-11-22(21)26-14-6-1-7-15-26/h2-5,8-13,16,24H,1,6-7,14-15,17H2,(H,25,27).
What are the key properties of N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide?
N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide has a molecular weight of 359.47 g/mol, XLogP of 4.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-2-(2-piperidin-1-ylanilino)acetamide is sourced from PubChem (CID 9100114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).