N-dibenzofuran-2-yl-3-methylbutanamide

C17H17NO2 — CID 18082320

IUPACN-dibenzofuran-2-yl-3-methylbutanamide
SMILESCC(C)CC(=O)Nc1ccc2oc3ccccc3c2c1
InChIInChI=1S/C17H17NO2/c1-11(2)9-17(19)18-12-7-8-16-14(10-12)13-5-3-4-6-15(13)20-16/h3-8,10-11H,9H2,1-2H3,(H,18,19)
InChIKeyNZGXHUCWFSBVQQ-UHFFFAOYSA-N
MW267.33 g/mol
LogP4.57
Rot. Bonds3

About N-dibenzofuran-2-yl-3-methylbutanamide

N-dibenzofuran-2-yl-3-methylbutanamide (PubChem CID 18082320) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is N-dibenzofuran-2-yl-3-methylbutanamide.

Molecular Properties

Compound NameN-dibenzofuran-2-yl-3-methylbutanamide
PubChem CID18082320
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC NameN-dibenzofuran-2-yl-3-methylbutanamide
SMILESCC(C)CC(=O)Nc1ccc2oc3ccccc3c2c1
InChIInChI=1S/C17H17NO2/c1-11(2)9-17(19)18-12-7-8-16-14(10-12)13-5-3-4-6-15(13)20-16/h3-8,10-11H,9H2,1-2H3,(H,18,19)
InChIKeyNZGXHUCWFSBVQQ-UHFFFAOYSA-N
XLogP4.57
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-dibenzofuran-2-ylpropanamide
CID 54996249
N-dibenzofuran-2-yl-2-[[(1R)-1-phenylethyl]amino]acetamide
CID 8519906
[2-(dibenzofuran-2-ylamino)-2-oxoethyl]-[(1R)-1-(3,4-difluorophenyl)ethyl]azanium
CID 8710645
1-dibenzofuran-2-yl-3-methylbutan-1-one
CID 43160223
[2-(dibenzofuran-2-ylamino)-2-oxoethyl]-methyl-[2-(4-methylanilino)-2-oxoethyl]azanium
CID 8555634
N-dibenzofuran-2-yl-2-pyrimidin-2-ylsulfanylacetamide
CID 8512010
N-dibenzofuran-2-yl-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 8569408
N-[(2S)-1-(dibenzofuran-2-ylamino)-1-oxopropan-2-yl]benzamide
CID 8002470
2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide
CID 2635783
N-dibenzofuran-2-yl-2,2,2-trifluoroacetamide
CID 5196274
[2-(dibenzofuran-2-ylamino)-2-oxoethyl]-[2-(2-ethylanilino)-2-oxoethyl]-methylazanium
CID 8556455
N-dibenzofuran-2-yl-2-(3-methyl-4-oxophthalazin-1-yl)acetamide
CID 71552342

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-2-yl-3-methylbutanamide?
The IUPAC name of N-dibenzofuran-2-yl-3-methylbutanamide (CID 18082320) is N-dibenzofuran-2-yl-3-methylbutanamide.
What is the SMILES notation for N-dibenzofuran-2-yl-3-methylbutanamide?
The canonical SMILES for N-dibenzofuran-2-yl-3-methylbutanamide is CC(C)CC(=O)Nc1ccc2oc3ccccc3c2c1.
What is the InChIKey of N-dibenzofuran-2-yl-3-methylbutanamide?
The InChIKey is NZGXHUCWFSBVQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c1-11(2)9-17(19)18-12-7-8-16-14(10-12)13-5-3-4-6-15(13)20-16/h3-8,10-11H,9H2,1-2H3,(H,18,19).
What are the key properties of N-dibenzofuran-2-yl-3-methylbutanamide?
N-dibenzofuran-2-yl-3-methylbutanamide has a molecular weight of 267.33 g/mol, XLogP of 4.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-2-yl-3-methylbutanamide is sourced from PubChem (CID 18082320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).