N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide

C15H22N2O2 — CID 62327374

IUPACN-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide
SMILESCCC(C)Oc1cccc(NC(=O)CNC2CC2)c1
InChIInChI=1S/C15H22N2O2/c1-3-11(2)19-14-6-4-5-13(9-14)17-15(18)10-16-12-7-8-12/h4-6,9,11-12,16H,3,7-8,10H2,1-2H3,(H,17,18)
InChIKeyAYICXZIVFNJDJZ-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.55
Rot. Bonds7

About N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide

N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide (PubChem CID 62327374) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide.

Molecular Properties

Compound NameN-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide
PubChem CID62327374
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide
SMILESCCC(C)Oc1cccc(NC(=O)CNC2CC2)c1
InChIInChI=1S/C15H22N2O2/c1-3-11(2)19-14-6-4-5-13(9-14)17-15(18)10-16-12-7-8-12/h4-6,9,11-12,16H,3,7-8,10H2,1-2H3,(H,17,18)
InChIKeyAYICXZIVFNJDJZ-UHFFFAOYSA-N
XLogP2.55
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide?
The IUPAC name of N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide (CID 62327374) is N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide.
What is the SMILES notation for N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide?
The canonical SMILES for N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide is CCC(C)Oc1cccc(NC(=O)CNC2CC2)c1.
What is the InChIKey of N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide?
The InChIKey is AYICXZIVFNJDJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-11(2)19-14-6-4-5-13(9-14)17-15(18)10-16-12-7-8-12/h4-6,9,11-12,16H,3,7-8,10H2,1-2H3,(H,17,18).
What are the key properties of N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide?
N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide has a molecular weight of 262.35 g/mol, XLogP of 2.55, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-butan-2-yloxyphenyl)-2-(cyclopropylamino)acetamide is sourced from PubChem (CID 62327374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).