2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide

C15H25N3O2 — CID 119892857

IUPAC2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide
SMILESCOCCCN(C)CCNC(=O)C(N)c1ccccc1
InChIInChI=1S/C15H25N3O2/c1-18(10-6-12-20-2)11-9-17-15(19)14(16)13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12,16H2,1-2H3,(H,17,19)
InChIKeySPKHAGWZOKKYSN-UHFFFAOYSA-N
MW279.38 g/mol
LogP0.77
Rot. Bonds9

About 2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide

2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide (PubChem CID 119892857) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide
PubChem CID119892857
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide
SMILESCOCCCN(C)CCNC(=O)C(N)c1ccccc1
InChIInChI=1S/C15H25N3O2/c1-18(10-6-12-20-2)11-9-17-15(19)14(16)13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12,16H2,1-2H3,(H,17,19)
InChIKeySPKHAGWZOKKYSN-UHFFFAOYSA-N
XLogP0.77
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride
CID 119262550
(2R)-2-amino-N-[3-(2-methoxyethoxy)propyl]-2-phenylacetamide
CID 61275798
2-amino-N-[2-(dimethylamino)ethyl]-2-phenylacetamide;hydrochloride
CID 120994237
3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide
CID 64566055
3-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]-2-methyl-3-phenylpropanamide
CID 119855410
(2R)-2-amino-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N-methyl-2-phenylacetamide
CID 61163818
2-amino-N-[3-[methyl(2,2,2-trifluoroethyl)amino]propyl]-2-phenylacetamide
CID 119855322
2-amino-N-[4-(dimethylamino)butyl]-2-phenylacetamide;dihydrochloride
CID 119852800
1-(2-methoxy-2-phenylethyl)-3-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-methylguanidine
CID 111650318
2-[[(2S)-2-amino-2-phenylacetyl]amino]ethyl carbamate
CID 104898331
2-amino-2-phenyl-N-(2-propan-2-yloxyethyl)acetamide
CID 113450222
1-ethyl-3-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-(2-phenylpropyl)guanidine
CID 111652056

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide?
The IUPAC name of 2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide (CID 119892857) is 2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide?
The canonical SMILES for 2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide is COCCCN(C)CCNC(=O)C(N)c1ccccc1.
What is the InChIKey of 2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide?
The InChIKey is SPKHAGWZOKKYSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-18(10-6-12-20-2)11-9-17-15(19)14(16)13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12,16H2,1-2H3,(H,17,19).
What are the key properties of 2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide?
2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide has a molecular weight of 279.38 g/mol, XLogP of 0.77, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide is sourced from PubChem (CID 119892857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).