N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide

C17H28N2O2 — CID 82990815

IUPACN-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide
SMILESCCC(C)C(C(=O)NCCNCCOC)c1ccccc1
InChIInChI=1S/C17H28N2O2/c1-4-14(2)16(15-8-6-5-7-9-15)17(20)19-11-10-18-12-13-21-3/h5-9,14,16,18H,4,10-13H2,1-3H3,(H,19,20)
InChIKeyKIIXFNUESMCZNA-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.17
Rot. Bonds10

About N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide

N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide (PubChem CID 82990815) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide.

Molecular Properties

Compound NameN-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide
PubChem CID82990815
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC NameN-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide
SMILESCCC(C)C(C(=O)NCCNCCOC)c1ccccc1
InChIInChI=1S/C17H28N2O2/c1-4-14(2)16(15-8-6-5-7-9-15)17(20)19-11-10-18-12-13-21-3/h5-9,14,16,18H,4,10-13H2,1-3H3,(H,19,20)
InChIKeyKIIXFNUESMCZNA-UHFFFAOYSA-N
XLogP2.17
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.17
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

3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide
CID 112794606
N-(2-aminobutyl)-3-methyl-2-phenylpentanamide
CID 63731148
N-(3-bromobutyl)-3-methyl-2-phenylpentanamide
CID 114312530
3-methoxy-N-[2-[(3-methyl-2-phenylpentanoyl)amino]ethyl]benzamide
CID 78846238
N-but-3-enyl-3-methyl-2-phenylpentanamide
CID 113466088
N-(3-chloro-2-methylpropyl)-3-methyl-2-phenylpentanamide
CID 114302680
N-(1-chloro-3-methoxypropan-2-yl)-3-methyl-2-phenylpentanamide
CID 106183441
N-(1,3-dihydroxypropan-2-yl)-3-methyl-2-phenylpentanamide
CID 65315116
(2R)-3-methyl-N-[2-[2-[[(2S)-3-methyl-2-phenylbutanoyl]amino]ethoxy]ethyl]-2-phenylbutanamide
CID 122660054
N-(1-bromopropan-2-yl)-3-methyl-2-phenylpentanamide
CID 114310573
N-[3-(furan-2-ylmethoxy)propyl]-3-methyl-2-phenylpentanamide
CID 78835063
(2S,3R)-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]butyl]-3-methyl-2-phenylpentanamide
CID 97025367

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide?
The IUPAC name of N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide (CID 82990815) is N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide.
What is the SMILES notation for N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide?
The canonical SMILES for N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide is CCC(C)C(C(=O)NCCNCCOC)c1ccccc1.
What is the InChIKey of N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide?
The InChIKey is KIIXFNUESMCZNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-4-14(2)16(15-8-6-5-7-9-15)17(20)19-11-10-18-12-13-21-3/h5-9,14,16,18H,4,10-13H2,1-3H3,(H,19,20).
What are the key properties of N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide?
N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide has a molecular weight of 292.42 g/mol, XLogP of 2.17, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide is sourced from PubChem (CID 82990815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).