2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide

C16H25N3O — CID 116653073

IUPAC2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide
SMILESCC(NC(=O)CN(C)C(CN)C1CC1)c1ccccc1
InChIInChI=1S/C16H25N3O/c1-12(13-6-4-3-5-7-13)18-16(20)11-19(2)15(10-17)14-8-9-14/h3-7,12,14-15H,8-11,17H2,1-2H3,(H,18,20)
InChIKeyRZSDLJFMCBADGB-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.53
Rot. Bonds7

About 2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide

2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide (PubChem CID 116653073) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide
PubChem CID116653073
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide
SMILESCC(NC(=O)CN(C)C(CN)C1CC1)c1ccccc1
InChIInChI=1S/C16H25N3O/c1-12(13-6-4-3-5-7-13)18-16(20)11-19(2)15(10-17)14-8-9-14/h3-7,12,14-15H,8-11,17H2,1-2H3,(H,18,20)
InChIKeyRZSDLJFMCBADGB-UHFFFAOYSA-N
XLogP1.53
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(2-phenylsulfanylethyl)acetamide
CID 116652424
2-[cyclohexyl(methyl)amino]-N-[(1R)-1-phenylethyl]acetamide
CID 8004439
2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-methylacetamide
CID 116652481
methyl 3-[(2-amino-1-cyclopropylethyl)-methylamino]-2-phenylpropanoate
CID 116653047
2-amino-N-(1-phenylethyl)acetamide
CID 10631169
2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(cyanomethyl)acetamide
CID 116652513
2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-prop-2-ynylacetamide
CID 116653113
3-amino-N-(1-phenylethyl)propanamide
CID 16784228
2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(4-ethylphenyl)acetamide
CID 116652660
2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 116652439
4-amino-3-methyl-N-[(1S)-1-phenylethyl]butanamide
CID 70328531
2-[benzyl(methyl)amino]-N-(1-phenylethyl)acetamide
CID 18078396

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide?
The IUPAC name of 2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide (CID 116653073) is 2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide.
What is the SMILES notation for 2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide?
The canonical SMILES for 2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide is CC(NC(=O)CN(C)C(CN)C1CC1)c1ccccc1.
What is the InChIKey of 2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide?
The InChIKey is RZSDLJFMCBADGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-12(13-6-4-3-5-7-13)18-16(20)11-19(2)15(10-17)14-8-9-14/h3-7,12,14-15H,8-11,17H2,1-2H3,(H,18,20).
What are the key properties of 2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide?
2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide has a molecular weight of 275.40 g/mol, XLogP of 1.53, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 116653073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).