2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride

C12H19ClN2O2 — CID 119262550

IUPAC2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride
SMILESCOCCCNC(=O)C(N)c1ccccc1.Cl
InChIInChI=1S/C12H18N2O2.ClH/c1-16-9-5-8-14-12(15)11(13)10-6-3-2-4-7-10;/h2-4,6-7,11H,5,8-9,13H2,1H3,(H,14,15);1H
InChIKeyKAMROGYIWWEIBH-UHFFFAOYSA-N
MW258.75 g/mol
LogP1.26
Rot. Bonds6

About 2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride

2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride (PubChem CID 119262550) has the molecular formula C12H19ClN2O2 and a molecular weight of 258.75 g/mol. Its IUPAC name is 2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride
PubChem CID119262550
Molecular FormulaC12H19ClN2O2
Molecular Weight258.75 g/mol
Exact Mass258.11
IUPAC Name2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride
SMILESCOCCCNC(=O)C(N)c1ccccc1.Cl
InChIInChI=1S/C12H18N2O2.ClH/c1-16-9-5-8-14-12(15)11(13)10-6-3-2-4-7-10;/h2-4,6-7,11H,5,8-9,13H2,1H3,(H,14,15);1H
InChIKeyKAMROGYIWWEIBH-UHFFFAOYSA-N
XLogP1.26
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.75
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-amino-N-[3-(2-methoxyethoxy)propyl]-2-phenylacetamide
CID 61275798
2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide
CID 119892857
3-amino-N-(4-methoxybutyl)-2-methyl-3-phenylpropanamide;hydrochloride
CID 119722375
(2R)-2-amino-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N-methyl-2-phenylacetamide
CID 61163818
2-[[(2S)-2-amino-2-phenylacetyl]amino]ethyl carbamate
CID 104898331
2-amino-N-(5-hydroxypentyl)-2-phenylacetamide
CID 69266542
(2S)-2-amino-N-decyl-2-phenylacetamide
CID 104898142
2-amino-N-[4-(dimethylamino)butyl]-2-phenylacetamide;dihydrochloride
CID 119852800
2-amino-N-(3-methoxypropyl)-3-phenylpropanamide
CID 43153328
(2S)-2-amino-N-[3-(cyclopropylmethoxy)propyl]-2-phenylacetamide
CID 93093422
2-amino-N-(3-methylsulfanylpropyl)-2-phenylacetamide
CID 63960595
2-amino-2-phenyl-N-(2-propan-2-yloxyethyl)acetamide
CID 113450222

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride?
The IUPAC name of 2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride (CID 119262550) is 2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride?
The canonical SMILES for 2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride is COCCCNC(=O)C(N)c1ccccc1.Cl.
What is the InChIKey of 2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride?
The InChIKey is KAMROGYIWWEIBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2.ClH/c1-16-9-5-8-14-12(15)11(13)10-6-3-2-4-7-10;/h2-4,6-7,11H,5,8-9,13H2,1H3,(H,14,15);1H.
What are the key properties of 2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride?
2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride has a molecular weight of 258.75 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride is sourced from PubChem (CID 119262550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).