2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide

C15H23N3O — CID 43575619

IUPAC2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)CC(CN)c1ccccc1
InChIInChI=1S/C15H23N3O/c1-18(11-15(19)17-14-7-8-14)10-13(9-16)12-5-3-2-4-6-12/h2-6,13-14H,7-11,16H2,1H3,(H,17,19)
InChIKeyLGYLOXFKZLTZBJ-UHFFFAOYSA-N
MW261.37 g/mol
LogP0.94
Rot. Bonds7

About 2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide

2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide (PubChem CID 43575619) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide
PubChem CID43575619
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)CC(CN)c1ccccc1
InChIInChI=1S/C15H23N3O/c1-18(11-15(19)17-14-7-8-14)10-13(9-16)12-5-3-2-4-6-12/h2-6,13-14H,7-11,16H2,1H3,(H,17,19)
InChIKeyLGYLOXFKZLTZBJ-UHFFFAOYSA-N
XLogP0.94
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]-2-phenylpropanoic acid
CID 64567705
N-cyclopropyl-2-[(3-hydrazinyl-3-oxo-2-phenylpropyl)-methylamino]acetamide
CID 64566681
2-[(3-amino-2-phenylpropyl)-methylamino]acetamide
CID 43532171
N-cycloheptyl-2-[(3-hydroxy-3-phenylpropyl)-methylamino]acetamide
CID 91835840
2-[acetyl(1-phenylethyl)amino]-N-cyclopropylacetamide
CID 113161940
2-[[2-(aminomethyl)phenyl]methyl-methylamino]-N-cyclopropylacetamide
CID 43575631
3-[(3-amino-2-phenylpropyl)-methylamino]-N-methylpropanamide
CID 106914853
2-[(3-amino-2-ethoxypropyl)-methylamino]-N-cyclopropylacetamide
CID 63070047
4-amino-N-cyclopropyl-3-(1-phenylethylamino)butanamide
CID 66430398
4-(3-phenylpentanoylamino)cyclohexane-1-carboxylic acid
CID 119229843
4-amino-N-cyclopropyl-3-(4-methoxyphenyl)butanamide
CID 112511397
2-[benzyl(methyl)amino]-N-cyclohexylacetamide
CID 54808837

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide?
The IUPAC name of 2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide (CID 43575619) is 2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide is CN(CC(=O)NC1CC1)CC(CN)c1ccccc1.
What is the InChIKey of 2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide?
The InChIKey is LGYLOXFKZLTZBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-18(11-15(19)17-14-7-8-14)10-13(9-16)12-5-3-2-4-6-12/h2-6,13-14H,7-11,16H2,1H3,(H,17,19).
What are the key properties of 2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide?
2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide has a molecular weight of 261.37 g/mol, XLogP of 0.94, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-2-phenylpropyl)-methylamino]-N-cyclopropylacetamide is sourced from PubChem (CID 43575619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).