N-(2-amino-2-phenylethyl)pentanamide

C13H20N2O — CID 63120587

IUPACN-(2-amino-2-phenylethyl)pentanamide
SMILESCCCCC(=O)NCC(N)c1ccccc1
InChIInChI=1S/C13H20N2O/c1-2-3-9-13(16)15-10-12(14)11-7-5-4-6-8-11/h4-8,12H,2-3,9-10,14H2,1H3,(H,15,16)
InChIKeyGDKGPBCGIITILO-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.99
Rot. Bonds6

About N-(2-amino-2-phenylethyl)pentanamide

N-(2-amino-2-phenylethyl)pentanamide (PubChem CID 63120587) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-(2-amino-2-phenylethyl)pentanamide.

Molecular Properties

Compound NameN-(2-amino-2-phenylethyl)pentanamide
PubChem CID63120587
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-(2-amino-2-phenylethyl)pentanamide
SMILESCCCCC(=O)NCC(N)c1ccccc1
InChIInChI=1S/C13H20N2O/c1-2-3-9-13(16)15-10-12(14)11-7-5-4-6-8-11/h4-8,12H,2-3,9-10,14H2,1H3,(H,15,16)
InChIKeyGDKGPBCGIITILO-UHFFFAOYSA-N
XLogP1.99
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-phenylethyl)hexanamide
CID 55225513
N-[(2S)-2-amino-2-phenylethyl]propanamide
CID 95015221
N-(2-amino-2-phenylethyl)-N',N'-dimethylpentanediamide;hydrochloride
CID 119527853
N-(2-amino-2-phenylethyl)-5-methoxypentanamide;hydrochloride
CID 119528731
N-(2-amino-2-phenylethyl)-4,4-dimethylpentanamide
CID 119529676
N-(3-amino-3-phenylpropyl)octanamide
CID 80506646
N-(2-amino-2-phenylethyl)-5-(4-methylphenyl)pentanamide
CID 119527817
N-(2-amino-2-phenylethyl)-2-propylsulfonylacetamide;hydrochloride
CID 119527676
N-(2-amino-2-phenylethyl)-4-(5-methylthiophen-2-yl)butanamide
CID 119529430
3-(hexanoylamino)-2-phenylpropanoic acid
CID 62883847
(2-amino-2-phenylethyl)carbamic acid
CID 66941802
N-(2-chloro-2-phenylethyl)decanamide
CID 114295700

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-phenylethyl)pentanamide?
The IUPAC name of N-(2-amino-2-phenylethyl)pentanamide (CID 63120587) is N-(2-amino-2-phenylethyl)pentanamide.
What is the SMILES notation for N-(2-amino-2-phenylethyl)pentanamide?
The canonical SMILES for N-(2-amino-2-phenylethyl)pentanamide is CCCCC(=O)NCC(N)c1ccccc1.
What is the InChIKey of N-(2-amino-2-phenylethyl)pentanamide?
The InChIKey is GDKGPBCGIITILO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-2-3-9-13(16)15-10-12(14)11-7-5-4-6-8-11/h4-8,12H,2-3,9-10,14H2,1H3,(H,15,16).
What are the key properties of N-(2-amino-2-phenylethyl)pentanamide?
N-(2-amino-2-phenylethyl)pentanamide has a molecular weight of 220.32 g/mol, XLogP of 1.99, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-phenylethyl)pentanamide is sourced from PubChem (CID 63120587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).