3-(3-butan-2-yloxyanilino)-N-ethylpropanamide

C15H24N2O2 — CID 62327713

IUPAC3-(3-butan-2-yloxyanilino)-N-ethylpropanamide
SMILESCCNC(=O)CCNc1cccc(OC(C)CC)c1
InChIInChI=1S/C15H24N2O2/c1-4-12(3)19-14-8-6-7-13(11-14)17-10-9-15(18)16-5-2/h6-8,11-12,17H,4-5,9-10H2,1-3H3,(H,16,18)
InChIKeyQBGZPOKMLANQLN-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.80
Rot. Bonds8

About 3-(3-butan-2-yloxyanilino)-N-ethylpropanamide

3-(3-butan-2-yloxyanilino)-N-ethylpropanamide (PubChem CID 62327713) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-(3-butan-2-yloxyanilino)-N-ethylpropanamide.

Molecular Properties

Compound Name3-(3-butan-2-yloxyanilino)-N-ethylpropanamide
PubChem CID62327713
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-(3-butan-2-yloxyanilino)-N-ethylpropanamide
SMILESCCNC(=O)CCNc1cccc(OC(C)CC)c1
InChIInChI=1S/C15H24N2O2/c1-4-12(3)19-14-8-6-7-13(11-14)17-10-9-15(18)16-5-2/h6-8,11-12,17H,4-5,9-10H2,1-3H3,(H,16,18)
InChIKeyQBGZPOKMLANQLN-UHFFFAOYSA-N
XLogP2.80
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 3-(3-butan-2-yloxyanilino)propanoate
CID 62327020
N-[2-(3-butan-2-yloxyanilino)ethyl]acetamide
CID 107529384
2-(3-butan-2-yloxyanilino)ethanol
CID 62328235
2-(3-butan-2-yloxyanilino)-N-methylacetamide
CID 54830374
2-(3-butan-2-yloxyanilino)acetic acid
CID 62328764
3-butan-2-yloxy-N-(3,3,3-trifluoropropyl)aniline
CID 64554822
N-(3-butan-2-yloxyphenyl)butanamide
CID 61394703
3-amino-N-(3-butan-2-yloxyphenyl)propanamide
CID 62327879
1-(3-butan-2-yloxyphenyl)-3-(3-methylbutyl)urea
CID 47392400
3-(3-butan-2-yloxyanilino)-2,2-dimethylpropanoic acid
CID 79624884
2-(3-butan-2-yloxyanilino)-N-(2-methylbutan-2-yl)acetamide
CID 62328408
3-butan-2-yloxy-N-(3-phenylpropyl)aniline
CID 54802732

Frequently Asked Questions

What is the IUPAC name of 3-(3-butan-2-yloxyanilino)-N-ethylpropanamide?
The IUPAC name of 3-(3-butan-2-yloxyanilino)-N-ethylpropanamide (CID 62327713) is 3-(3-butan-2-yloxyanilino)-N-ethylpropanamide.
What is the SMILES notation for 3-(3-butan-2-yloxyanilino)-N-ethylpropanamide?
The canonical SMILES for 3-(3-butan-2-yloxyanilino)-N-ethylpropanamide is CCNC(=O)CCNc1cccc(OC(C)CC)c1.
What is the InChIKey of 3-(3-butan-2-yloxyanilino)-N-ethylpropanamide?
The InChIKey is QBGZPOKMLANQLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-12(3)19-14-8-6-7-13(11-14)17-10-9-15(18)16-5-2/h6-8,11-12,17H,4-5,9-10H2,1-3H3,(H,16,18).
What are the key properties of 3-(3-butan-2-yloxyanilino)-N-ethylpropanamide?
3-(3-butan-2-yloxyanilino)-N-ethylpropanamide has a molecular weight of 264.37 g/mol, XLogP of 2.80, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-butan-2-yloxyanilino)-N-ethylpropanamide is sourced from PubChem (CID 62327713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).