2-(cyclopropylamino)-3-methyl-2-phenylbutanamide

C14H20N2O — CID 60872947

IUPAC2-(cyclopropylamino)-3-methyl-2-phenylbutanamide
SMILESCC(C)C(NC1CC1)(C(N)=O)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-10(2)14(13(15)17,16-12-8-9-12)11-6-4-3-5-7-11/h3-7,10,12,16H,8-9H2,1-2H3,(H2,15,17)
InChIKeyNNQUVQFMYOYRIA-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.78
Rot. Bonds5

About 2-(cyclopropylamino)-3-methyl-2-phenylbutanamide

2-(cyclopropylamino)-3-methyl-2-phenylbutanamide (PubChem CID 60872947) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-(cyclopropylamino)-3-methyl-2-phenylbutanamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-3-methyl-2-phenylbutanamide
PubChem CID60872947
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-(cyclopropylamino)-3-methyl-2-phenylbutanamide
SMILESCC(C)C(NC1CC1)(C(N)=O)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-10(2)14(13(15)17,16-12-8-9-12)11-6-4-3-5-7-11/h3-7,10,12,16H,8-9H2,1-2H3,(H2,15,17)
InChIKeyNNQUVQFMYOYRIA-UHFFFAOYSA-N
XLogP1.78
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-anilino-3-methyl-2-phenylbutanamide
CID 60996428
2-(4-fluoroanilino)-3-methyl-2-phenylbutanamide
CID 60997141
N-(1-amino-3-methyl-1-oxo-2-phenylbutan-2-yl)-2-hydroxybenzamide
CID 150830185
2-(cycloheptylamino)-2-phenylpropanamide
CID 54892648
4-tert-butylsulfanyl-2-(cyclopropylamino)-2-phenylbutanamide
CID 116694565
2-(cyclopropylamino)-2-methyl-4-phenoxypentanamide
CID 64706033
2-(cyclopropylamino)-3-(3-hydroxybutan-2-ylsulfanyl)-2-phenylpropanoic acid
CID 107771893
2-acetamido-3-methyl-2-phenylbutanoic acid
CID 63701624
2-(cyclopropylamino)-2-phenyl-4-propoxybutanamide
CID 116694311
2-(cyclopentylamino)-3-methoxy-2-phenylpropanamide
CID 103464910
2-benzyl-2-(cyclopropylamino)butanamide
CID 79007963
2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide
CID 60795288

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-3-methyl-2-phenylbutanamide?
The IUPAC name of 2-(cyclopropylamino)-3-methyl-2-phenylbutanamide (CID 60872947) is 2-(cyclopropylamino)-3-methyl-2-phenylbutanamide.
What is the SMILES notation for 2-(cyclopropylamino)-3-methyl-2-phenylbutanamide?
The canonical SMILES for 2-(cyclopropylamino)-3-methyl-2-phenylbutanamide is CC(C)C(NC1CC1)(C(N)=O)c1ccccc1.
What is the InChIKey of 2-(cyclopropylamino)-3-methyl-2-phenylbutanamide?
The InChIKey is NNQUVQFMYOYRIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10(2)14(13(15)17,16-12-8-9-12)11-6-4-3-5-7-11/h3-7,10,12,16H,8-9H2,1-2H3,(H2,15,17).
What are the key properties of 2-(cyclopropylamino)-3-methyl-2-phenylbutanamide?
2-(cyclopropylamino)-3-methyl-2-phenylbutanamide has a molecular weight of 232.33 g/mol, XLogP of 1.78, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-3-methyl-2-phenylbutanamide is sourced from PubChem (CID 60872947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).