(2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide

C15H22N2O2 — CID 104898158

IUPAC(2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide
SMILESCN(CCOCC1CC1)C(=O)[C@@H](N)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-17(9-10-19-11-12-7-8-12)15(18)14(16)13-5-3-2-4-6-13/h2-6,12,14H,7-11,16H2,1H3/t14-/m0/s1
InChIKeyYIQXFVHTMPLEMQ-AWEZNQCLSA-N
MW262.35 g/mol
LogP1.57
Rot. Bonds7

About (2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide

(2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide (PubChem CID 104898158) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is (2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide
PubChem CID104898158
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name(2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide
SMILESCN(CCOCC1CC1)C(=O)[C@@H](N)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-17(9-10-19-11-12-7-8-12)15(18)14(16)13-5-3-2-4-6-13/h2-6,12,14H,7-11,16H2,1H3/t14-/m0/s1
InChIKeyYIQXFVHTMPLEMQ-AWEZNQCLSA-N
XLogP1.57
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-methyl-2-phenyl-N-(2-phenylmethoxyethyl)acetamide
CID 119345164
(2S)-2-amino-N-[3-(cyclopropylmethoxy)propyl]-2-phenylacetamide
CID 93093422
2-amino-N-methyl-2-(4-methylphenyl)-N-(2-phenylmethoxyethyl)acetamide;hydrochloride
CID 120669222
(2S)-2-amino-N-(cyclopropylmethyl)-2-phenyl-N-propylacetamide
CID 93193539
2-amino-N-[2-(2-methoxyphenoxy)ethyl]-N-methyl-2-phenylacetamide;hydrochloride
CID 119294061
2-cyclopropylethyl (2S)-2-amino-2-phenylacetate
CID 106202488
(2R)-2-amino-N-methyl-N-(oxan-4-ylmethyl)-2-phenylacetamide
CID 63706468
3-amino-N-(2-ethoxyethyl)-N,2-dimethyl-3-phenylpropanamide
CID 81059342
2-amino-N-cyclopropyl-N-(2-methoxyethyl)-2-phenylacetamide
CID 54872258
3,5-dibromo-N-[2-(cyclopropylmethoxy)ethyl]-N-methylbenzamide
CID 113349801
(2S)-2-amino-N-methyl-2-phenyl-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 104897872
(2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-4-methylsulfanylbutanamide;hydrochloride
CID 119340566

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide?
The IUPAC name of (2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide (CID 104898158) is (2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide.
What is the SMILES notation for (2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide?
The canonical SMILES for (2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide is CN(CCOCC1CC1)C(=O)[C@@H](N)c1ccccc1.
What is the InChIKey of (2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide?
The InChIKey is YIQXFVHTMPLEMQ-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-17(9-10-19-11-12-7-8-12)15(18)14(16)13-5-3-2-4-6-13/h2-6,12,14H,7-11,16H2,1H3/t14-/m0/s1.
What are the key properties of (2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide?
(2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide has a molecular weight of 262.35 g/mol, XLogP of 1.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-phenylacetamide is sourced from PubChem (CID 104898158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).