2-benzyl-2-(cyclopropylamino)butanamide

C14H20N2O — CID 79007963

IUPAC2-benzyl-2-(cyclopropylamino)butanamide
SMILESCCC(Cc1ccccc1)(NC1CC1)C(N)=O
InChIInChI=1S/C14H20N2O/c1-2-14(13(15)17,16-12-8-9-12)10-11-6-4-3-5-7-11/h3-7,12,16H,2,8-10H2,1H3,(H2,15,17)
InChIKeyLJRFNUFPHROZOH-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.62
Rot. Bonds6

About 2-benzyl-2-(cyclopropylamino)butanamide

2-benzyl-2-(cyclopropylamino)butanamide (PubChem CID 79007963) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-benzyl-2-(cyclopropylamino)butanamide.

Molecular Properties

Compound Name2-benzyl-2-(cyclopropylamino)butanamide
PubChem CID79007963
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-benzyl-2-(cyclopropylamino)butanamide
SMILESCCC(Cc1ccccc1)(NC1CC1)C(N)=O
InChIInChI=1S/C14H20N2O/c1-2-14(13(15)17,16-12-8-9-12)10-11-6-4-3-5-7-11/h3-7,12,16H,2,8-10H2,1H3,(H2,15,17)
InChIKeyLJRFNUFPHROZOH-UHFFFAOYSA-N
XLogP1.62
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopropylamino)-2-methyl-3-phenylpropanoic acid
CID 114988664
2-benzyl-2-(cyclopropylmethylamino)butanoic acid
CID 79008033
2-benzyl-2-(4-bromoanilino)butanamide
CID 79008847
2-(cyclohexylamino)-2-[(4-hydroxyphenyl)methyl]butanoic acid
CID 69495970
2-(cyclopropylamino)-2-ethylbutanoic acid
CID 43754498
2-[(1-benzylpiperidin-4-yl)amino]-2-methylpropanamide
CID 61211452
benzyl N-(4-propylcyclohexyl)carbamate
CID 130580975
2-acetamido-2-benzyl-4,4,4-triiodobutanamide
CID 140966049
4-benzylsulfanyl-2-(cyclopropylamino)-2-methylpentanamide
CID 64709096
2-benzyl-2-(ethylamino)-3-phenylpropanoic acid
CID 43753784
(2S)-2-[(4-hydroxyphenyl)methyl]-2-(3-phenylpropanoylamino)butanoic acid
CID 68843476
2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide
CID 62230821

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-2-(cyclopropylamino)butanamide?
The IUPAC name of 2-benzyl-2-(cyclopropylamino)butanamide (CID 79007963) is 2-benzyl-2-(cyclopropylamino)butanamide.
What is the SMILES notation for 2-benzyl-2-(cyclopropylamino)butanamide?
The canonical SMILES for 2-benzyl-2-(cyclopropylamino)butanamide is CCC(Cc1ccccc1)(NC1CC1)C(N)=O.
What is the InChIKey of 2-benzyl-2-(cyclopropylamino)butanamide?
The InChIKey is LJRFNUFPHROZOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-2-14(13(15)17,16-12-8-9-12)10-11-6-4-3-5-7-11/h3-7,12,16H,2,8-10H2,1H3,(H2,15,17).
What are the key properties of 2-benzyl-2-(cyclopropylamino)butanamide?
2-benzyl-2-(cyclopropylamino)butanamide has a molecular weight of 232.33 g/mol, XLogP of 1.62, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-2-(cyclopropylamino)butanamide is sourced from PubChem (CID 79007963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).