2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide

C16H18N2O — CID 116674289

IUPAC2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide
SMILESCC(C(=O)Nc1cccc2ccccc12)C1CNC1
InChIInChI=1S/C16H18N2O/c1-11(13-9-17-10-13)16(19)18-15-8-4-6-12-5-2-3-7-14(12)15/h2-8,11,13,17H,9-10H2,1H3,(H,18,19)
InChIKeyMFOFSRDLVKKWQJ-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.63
Rot. Bonds3

About 2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide

2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide (PubChem CID 116674289) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide
PubChem CID116674289
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide
SMILESCC(C(=O)Nc1cccc2ccccc12)C1CNC1
InChIInChI=1S/C16H18N2O/c1-11(13-9-17-10-13)16(19)18-15-8-4-6-12-5-2-3-7-14(12)15/h2-8,11,13,17H,9-10H2,1H3,(H,18,19)
InChIKeyMFOFSRDLVKKWQJ-UHFFFAOYSA-N
XLogP2.63
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azetidin-3-yl)-N-(2-iodophenyl)propanamide
CID 116674715
2-(azetidin-3-yl)-N-[2-(trifluoromethoxy)phenyl]propanamide
CID 116674418
N-naphthalen-1-yl-2-piperazin-1-ylpropanamide
CID 43089580
2-bromo-3-methyl-N-naphthalen-1-ylbutanamide
CID 4074049
N'-naphthalen-1-yl-N-(2-propan-2-ylphenyl)oxamide
CID 108500558
2-(azetidin-3-yl)-N-(4-phenylphenyl)propanamide
CID 116675538
1-(2-hydroxypropyl)-3-naphthalen-1-ylurea
CID 17468556
2-methyl-N-naphthalen-1-ylpentanamide
CID 112762783
1-naphthalen-1-yl-3-[2-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 177491059
1-naphthalen-1-yl-3-[5-(naphthalen-1-ylcarbamoylamino)naphthalen-1-yl]urea
CID 27190755
(2S)-2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-N-naphthalen-1-ylpropanamide
CID 8929833
(2S)-2-[(3R,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-N-naphthalen-1-ylpropanamide
CID 8929830

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide?
The IUPAC name of 2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide (CID 116674289) is 2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide is CC(C(=O)Nc1cccc2ccccc12)C1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide?
The InChIKey is MFOFSRDLVKKWQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-11(13-9-17-10-13)16(19)18-15-8-4-6-12-5-2-3-7-14(12)15/h2-8,11,13,17H,9-10H2,1H3,(H,18,19).
What are the key properties of 2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide?
2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide has a molecular weight of 254.33 g/mol, XLogP of 2.63, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide is sourced from PubChem (CID 116674289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).