2-(naphthalen-2-ylamino)-N-propylacetamide

C15H18N2O — CID 43400801

IUPAC2-(naphthalen-2-ylamino)-N-propylacetamide
SMILESCCCNC(=O)CNc1ccc2ccccc2c1
InChIInChI=1S/C15H18N2O/c1-2-9-16-15(18)11-17-14-8-7-12-5-3-4-6-13(12)10-14/h3-8,10,17H,2,9,11H2,1H3,(H,16,18)
InChIKeyRIHMPHBFJWTXPQ-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.78
Rot. Bonds5

About 2-(naphthalen-2-ylamino)-N-propylacetamide

2-(naphthalen-2-ylamino)-N-propylacetamide (PubChem CID 43400801) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(naphthalen-2-ylamino)-N-propylacetamide.

Molecular Properties

Compound Name2-(naphthalen-2-ylamino)-N-propylacetamide
PubChem CID43400801
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name2-(naphthalen-2-ylamino)-N-propylacetamide
SMILESCCCNC(=O)CNc1ccc2ccccc2c1
InChIInChI=1S/C15H18N2O/c1-2-9-16-15(18)11-17-14-8-7-12-5-3-4-6-13(12)10-14/h3-8,10,17H,2,9,11H2,1H3,(H,16,18)
InChIKeyRIHMPHBFJWTXPQ-UHFFFAOYSA-N
XLogP2.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(naphthalen-2-ylamino)-N-propylacetamide?
The IUPAC name of 2-(naphthalen-2-ylamino)-N-propylacetamide (CID 43400801) is 2-(naphthalen-2-ylamino)-N-propylacetamide.
What is the SMILES notation for 2-(naphthalen-2-ylamino)-N-propylacetamide?
The canonical SMILES for 2-(naphthalen-2-ylamino)-N-propylacetamide is CCCNC(=O)CNc1ccc2ccccc2c1.
What is the InChIKey of 2-(naphthalen-2-ylamino)-N-propylacetamide?
The InChIKey is RIHMPHBFJWTXPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-2-9-16-15(18)11-17-14-8-7-12-5-3-4-6-13(12)10-14/h3-8,10,17H,2,9,11H2,1H3,(H,16,18).
What are the key properties of 2-(naphthalen-2-ylamino)-N-propylacetamide?
2-(naphthalen-2-ylamino)-N-propylacetamide has a molecular weight of 242.32 g/mol, XLogP of 2.78, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(naphthalen-2-ylamino)-N-propylacetamide is sourced from PubChem (CID 43400801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).