N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide

C17H20N2O — CID 3078987

IUPACN-(1,2,3,4-tetrahydroacridin-9-yl)butanamide
SMILESCCCC(=O)Nc1c2c(nc3ccccc13)CCCC2
InChIInChI=1S/C17H20N2O/c1-2-7-16(20)19-17-12-8-3-5-10-14(12)18-15-11-6-4-9-13(15)17/h3,5,8,10H,2,4,6-7,9,11H2,1H3,(H,18,19,20)
InChIKeyHHGNFMTUNLFUTN-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.85
Rot. Bonds3

About N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide

N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide (PubChem CID 3078987) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydroacridin-9-yl)butanamide
PubChem CID3078987
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-(1,2,3,4-tetrahydroacridin-9-yl)butanamide
SMILESCCCC(=O)Nc1c2c(nc3ccccc13)CCCC2
InChIInChI=1S/C17H20N2O/c1-2-7-16(20)19-17-12-8-3-5-10-14(12)18-15-11-6-4-9-13(15)17/h3,5,8,10H,2,4,6-7,9,11H2,1H3,(H,18,19,20)
InChIKeyHHGNFMTUNLFUTN-UHFFFAOYSA-N
XLogP3.85
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide?
The IUPAC name of N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide (CID 3078987) is N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide.
What is the SMILES notation for N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide?
The canonical SMILES for N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide is CCCC(=O)Nc1c2c(nc3ccccc13)CCCC2.
What is the InChIKey of N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide?
The InChIKey is HHGNFMTUNLFUTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-2-7-16(20)19-17-12-8-3-5-10-14(12)18-15-11-6-4-9-13(15)17/h3,5,8,10H,2,4,6-7,9,11H2,1H3,(H,18,19,20).
What are the key properties of N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide?
N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide has a molecular weight of 268.36 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4-tetrahydroacridin-9-yl)butanamide is sourced from PubChem (CID 3078987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).