3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide

C14H20N2O — CID 113266937

IUPAC3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide
SMILESCC1CC(NC(=O)C(CN)c2ccccc2)C1
InChIInChI=1S/C14H20N2O/c1-10-7-12(8-10)16-14(17)13(9-15)11-5-3-2-4-6-11/h2-6,10,12-13H,7-9,15H2,1H3,(H,16,17)
InChIKeyDXDHWBSUVWFNRI-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.64
Rot. Bonds4

About 3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide

3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide (PubChem CID 113266937) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide
PubChem CID113266937
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide
SMILESCC1CC(NC(=O)C(CN)c2ccccc2)C1
InChIInChI=1S/C14H20N2O/c1-10-7-12(8-10)16-14(17)13(9-15)11-5-3-2-4-6-11/h2-6,10,12-13H,7-9,15H2,1H3,(H,16,17)
InChIKeyDXDHWBSUVWFNRI-UHFFFAOYSA-N
XLogP1.64
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(2-ethylcyclopropyl)-2-phenylpropanamide
CID 103811259
3-amino-N-(1-methylpiperidin-4-yl)-2-phenylpropanamide
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3-amino-N-(oxolan-3-yl)-2-phenylpropanamide
CID 80717092
4-[(3-amino-2-phenylpropanoyl)amino]cyclohexane-1-carboxamide;hydrochloride
CID 119776410
2-chloro-N-(3,5-dimethylcyclohexyl)-2-phenylacetamide
CID 64734444
3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride
CID 119790806
3-amino-N-(5-oxopyrrolidin-3-yl)-2-phenylpropanamide
CID 106186177
ethyl 4-[(3-amino-2-phenylpropanoyl)amino]cyclohexane-1-carboxylate
CID 119738180
3-amino-N-(1-methylsulfonylpiperidin-4-yl)-2-phenylpropanamide
CID 119699916
3-amino-N-(1,1-dioxothiolan-3-yl)-2-phenylpropanamide;hydrochloride
CID 119670194
3-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-phenylpropanamide;hydrochloride
CID 119817851
ethyl 4-[(3-amino-2-phenylpropanoyl)amino]cyclohexane-1-carboxylate;hydrochloride
CID 119738179

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide?
The IUPAC name of 3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide (CID 113266937) is 3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide.
What is the SMILES notation for 3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide?
The canonical SMILES for 3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide is CC1CC(NC(=O)C(CN)c2ccccc2)C1.
What is the InChIKey of 3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide?
The InChIKey is DXDHWBSUVWFNRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10-7-12(8-10)16-14(17)13(9-15)11-5-3-2-4-6-11/h2-6,10,12-13H,7-9,15H2,1H3,(H,16,17).
What are the key properties of 3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide?
3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide has a molecular weight of 232.33 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide is sourced from PubChem (CID 113266937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).