N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide

C13H24N2O3 — CID 110026504

IUPACN-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide
SMILESCCCCCN(CC(N)=O)C(=O)C1CCCC1O
InChIInChI=1S/C13H24N2O3/c1-2-3-4-8-15(9-12(14)17)13(18)10-6-5-7-11(10)16/h10-11,16H,2-9H2,1H3,(H2,14,17)
InChIKeyVAMMRNPNVWHDEQ-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.65
Rot. Bonds7

About N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide

N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide (PubChem CID 110026504) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide
PubChem CID110026504
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC NameN-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide
SMILESCCCCCN(CC(N)=O)C(=O)C1CCCC1O
InChIInChI=1S/C13H24N2O3/c1-2-3-4-8-15(9-12(14)17)13(18)10-6-5-7-11(10)16/h10-11,16H,2-9H2,1H3,(H2,14,17)
InChIKeyVAMMRNPNVWHDEQ-UHFFFAOYSA-N
XLogP0.65
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.65
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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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide (CID 110026504) is N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide is CCCCCN(CC(N)=O)C(=O)C1CCCC1O.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide?
The InChIKey is VAMMRNPNVWHDEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-2-3-4-8-15(9-12(14)17)13(18)10-6-5-7-11(10)16/h10-11,16H,2-9H2,1H3,(H2,14,17).
What are the key properties of N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide?
N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide has a molecular weight of 256.35 g/mol, XLogP of 0.65, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-2-hydroxy-N-pentylcyclopentane-1-carboxamide is sourced from PubChem (CID 110026504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).