2-amino-N-(5-hydroxypentyl)-2-phenylacetamide

C13H20N2O2 — CID 69266542

IUPAC2-amino-N-(5-hydroxypentyl)-2-phenylacetamide
SMILESNC(C(=O)NCCCCCO)c1ccccc1
InChIInChI=1S/C13H20N2O2/c14-12(11-7-3-1-4-8-11)13(17)15-9-5-2-6-10-16/h1,3-4,7-8,12,16H,2,5-6,9-10,14H2,(H,15,17)
InChIKeyWEPRNXUOKNXAHO-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.97
Rot. Bonds7

About 2-amino-N-(5-hydroxypentyl)-2-phenylacetamide

2-amino-N-(5-hydroxypentyl)-2-phenylacetamide (PubChem CID 69266542) has the molecular formula C13H20N2O2 and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-amino-N-(5-hydroxypentyl)-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-(5-hydroxypentyl)-2-phenylacetamide
PubChem CID69266542
Molecular FormulaC13H20N2O2
Molecular Weight236.32 g/mol
Exact Mass236.15
IUPAC Name2-amino-N-(5-hydroxypentyl)-2-phenylacetamide
SMILESNC(C(=O)NCCCCCO)c1ccccc1
InChIInChI=1S/C13H20N2O2/c14-12(11-7-3-1-4-8-11)13(17)15-9-5-2-6-10-16/h1,3-4,7-8,12,16H,2,5-6,9-10,14H2,(H,15,17)
InChIKeyWEPRNXUOKNXAHO-UHFFFAOYSA-N
XLogP0.97
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-amino-N-decyl-2-phenylacetamide
CID 104898142
(2S)-2-amino-N-(7-methyloctyl)-2-phenylacetamide
CID 104897653
3-amino-N-(5-hydroxypentyl)-2-methyl-3-phenylpropanamide
CID 107317767
(2R)-2-amino-N-(5-methylsulfanylpentyl)-2-phenylacetamide
CID 114127295
(2R)-2-amino-N-[2-(3-hydroxypropylsulfanyl)ethyl]-2-phenylacetamide
CID 114171939
2-amino-N-(3-formamidopropyl)-2-phenylacetamide
CID 110463054
2-amino-N-[4-(dimethylamino)butyl]-2-phenylacetamide;dihydrochloride
CID 119852800
2-amino-N-(3-methylsulfanylpropyl)-2-phenylacetamide
CID 63960595
2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride
CID 119262550
5-[[(2S)-2-amino-2-phenylacetyl]amino]-2-methylpentanoic acid
CID 103870672
2-amino-N-ethyl-2-phenylacetamide
CID 22262703
2-(carbamoylamino)-N-(4-hydroxybutyl)-2-phenylacetamide
CID 106842975

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-hydroxypentyl)-2-phenylacetamide?
The IUPAC name of 2-amino-N-(5-hydroxypentyl)-2-phenylacetamide (CID 69266542) is 2-amino-N-(5-hydroxypentyl)-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-(5-hydroxypentyl)-2-phenylacetamide?
The canonical SMILES for 2-amino-N-(5-hydroxypentyl)-2-phenylacetamide is NC(C(=O)NCCCCCO)c1ccccc1.
What is the InChIKey of 2-amino-N-(5-hydroxypentyl)-2-phenylacetamide?
The InChIKey is WEPRNXUOKNXAHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c14-12(11-7-3-1-4-8-11)13(17)15-9-5-2-6-10-16/h1,3-4,7-8,12,16H,2,5-6,9-10,14H2,(H,15,17).
What are the key properties of 2-amino-N-(5-hydroxypentyl)-2-phenylacetamide?
2-amino-N-(5-hydroxypentyl)-2-phenylacetamide has a molecular weight of 236.32 g/mol, XLogP of 0.97, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-hydroxypentyl)-2-phenylacetamide is sourced from PubChem (CID 69266542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).