2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide

C20H27NO3 — CID 100763958

IUPAC2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide
SMILESCCCOC(C)(C)C(=O)Nc1ccc(OC(C)C)c2ccccc12
InChIInChI=1S/C20H27NO3/c1-6-13-23-20(4,5)19(22)21-17-11-12-18(24-14(2)3)16-10-8-7-9-15(16)17/h7-12,14H,6,13H2,1-5H3,(H,21,22)
InChIKeySCWZOMAKSIBNFD-UHFFFAOYSA-N
MW329.44 g/mol
LogP4.77
Rot. Bonds7

About 2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide

2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide (PubChem CID 100763958) has the molecular formula C20H27NO3 and a molecular weight of 329.44 g/mol. Its IUPAC name is 2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide.

Molecular Properties

Compound Name2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide
PubChem CID100763958
Molecular FormulaC20H27NO3
Molecular Weight329.44 g/mol
Exact Mass329.20
IUPAC Name2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide
SMILESCCCOC(C)(C)C(=O)Nc1ccc(OC(C)C)c2ccccc12
InChIInChI=1S/C20H27NO3/c1-6-13-23-20(4,5)19(22)21-17-11-12-18(24-14(2)3)16-10-8-7-9-15(16)17/h7-12,14H,6,13H2,1-5H3,(H,21,22)
InChIKeySCWZOMAKSIBNFD-UHFFFAOYSA-N
XLogP4.77
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxyhexanamide
CID 133205372
2-methyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide
CID 100777551
(2S)-N-[4-[(2S)-butan-2-yl]oxynaphthalen-1-yl]-2-methyl-2-propoxybutanamide
CID 100764450
2-ethoxy-4-methyl-2-(2-methylpropyl)-N-(4-propan-2-yloxynaphthalen-1-yl)pentanamide
CID 100760592
2,2-diphenyl-N-(4-propan-2-yloxynaphthalen-1-yl)butanamide
CID 100781678
2-bromo-N-[4-[(2S)-butan-2-yl]oxynaphthalen-1-yl]-2-methylpropanamide
CID 100751670
N-(4-butan-2-yloxynaphthalen-1-yl)-2-ethoxy-2-methylheptanamide
CID 133203923
N-(4-ethoxynaphthalen-1-yl)-2-methyl-2-propoxybutanamide
CID 133204053
2-methoxy-2-methyl-N-(4-propoxynaphthalen-1-yl)butanamide
CID 133229716
N-(4-ethoxynaphthalen-1-yl)-4-methyl-2-(2-methylpropyl)-2-propoxypentanamide
CID 100765689
2-methoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]propanamide
CID 100752413
N-[4-[(2S)-butan-2-yl]oxynaphthalen-1-yl]-2-ethoxy-4-methyl-2-(2-methylpropyl)pentanamide
CID 100760606

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide?
The IUPAC name of 2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide (CID 100763958) is 2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide.
What is the SMILES notation for 2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide?
The canonical SMILES for 2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide is CCCOC(C)(C)C(=O)Nc1ccc(OC(C)C)c2ccccc12.
What is the InChIKey of 2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide?
The InChIKey is SCWZOMAKSIBNFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27NO3/c1-6-13-23-20(4,5)19(22)21-17-11-12-18(24-14(2)3)16-10-8-7-9-15(16)17/h7-12,14H,6,13H2,1-5H3,(H,21,22).
What are the key properties of 2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide?
2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide has a molecular weight of 329.44 g/mol, XLogP of 4.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxypropanamide is sourced from PubChem (CID 100763958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).