2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide

C16H24N2O — CID 60795288

IUPAC2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide
SMILESCC(C)(C)c1ccc(C(C)(NC2CC2)C(N)=O)cc1
InChIInChI=1S/C16H24N2O/c1-15(2,3)11-5-7-12(8-6-11)16(4,14(17)19)18-13-9-10-13/h5-8,13,18H,9-10H2,1-4H3,(H2,17,19)
InChIKeyZPPBVCIMJGNEPX-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.44
Rot. Bonds4

About 2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide

2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide (PubChem CID 60795288) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide.

Molecular Properties

Compound Name2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide
PubChem CID60795288
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide
SMILESCC(C)(C)c1ccc(C(C)(NC2CC2)C(N)=O)cc1
InChIInChI=1S/C16H24N2O/c1-15(2,3)11-5-7-12(8-6-11)16(4,14(17)19)18-13-9-10-13/h5-8,13,18H,9-10H2,1-4H3,(H2,17,19)
InChIKeyZPPBVCIMJGNEPX-UHFFFAOYSA-N
XLogP2.44
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopropylamino)-2-pyridin-4-ylpropanamide
CID 60795921
2-(cyclopentylamino)-2-(4-hydroxyphenyl)propanamide
CID 54894194
2-(cycloheptylamino)-2-phenylpropanamide
CID 54892648
2-(cyclopentylamino)-2-(4-ethoxyphenyl)propanamide
CID 60999099
2-(cyclopropylamino)-2-(4-hydroxyphenyl)propanoic acid
CID 43754473
2-(cyclopentylamino)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide
CID 60998760
2-(4-chlorophenyl)-2-(cyclopropylamino)propanoic acid
CID 43754458
2-(cyclopentylamino)-2-(3-hydroxyphenyl)propanamide
CID 54894241
2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide
CID 104653342
2-(cyclohexylamino)-2-(3,5-dihydroxyphenyl)propanamide
CID 107707551
2-(3-bromophenyl)-2-(cyclopentylamino)propanamide
CID 54893904
2-(cyclopropylamino)-2-(2,4-difluorophenyl)propanamide
CID 60795802

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide?
The IUPAC name of 2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide (CID 60795288) is 2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide.
What is the SMILES notation for 2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide?
The canonical SMILES for 2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide is CC(C)(C)c1ccc(C(C)(NC2CC2)C(N)=O)cc1.
What is the InChIKey of 2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide?
The InChIKey is ZPPBVCIMJGNEPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-15(2,3)11-5-7-12(8-6-11)16(4,14(17)19)18-13-9-10-13/h5-8,13,18H,9-10H2,1-4H3,(H2,17,19).
What are the key properties of 2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide?
2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide has a molecular weight of 260.38 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide is sourced from PubChem (CID 60795288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).