2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide

C17H24N2O3 — CID 109397769

IUPAC2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide
SMILESCN(CC(=O)NCC(=O)c1ccccc1)CC1CCCC1O
InChIInChI=1S/C17H24N2O3/c1-19(11-14-8-5-9-15(14)20)12-17(22)18-10-16(21)13-6-3-2-4-7-13/h2-4,6-7,14-15,20H,5,8-12H2,1H3,(H,18,22)
InChIKeyPHZMREUEHONQQT-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.08
Rot. Bonds7

About 2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide

2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide (PubChem CID 109397769) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide.

Molecular Properties

Compound Name2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide
PubChem CID109397769
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide
SMILESCN(CC(=O)NCC(=O)c1ccccc1)CC1CCCC1O
InChIInChI=1S/C17H24N2O3/c1-19(11-14-8-5-9-15(14)20)12-17(22)18-10-16(21)13-6-3-2-4-7-13/h2-4,6-7,14-15,20H,5,8-12H2,1H3,(H,18,22)
InChIKeyPHZMREUEHONQQT-UHFFFAOYSA-N
XLogP1.08
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide?
The IUPAC name of 2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide (CID 109397769) is 2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide.
What is the SMILES notation for 2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide?
The canonical SMILES for 2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide is CN(CC(=O)NCC(=O)c1ccccc1)CC1CCCC1O.
What is the InChIKey of 2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide?
The InChIKey is PHZMREUEHONQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-19(11-14-8-5-9-15(14)20)12-17(22)18-10-16(21)13-6-3-2-4-7-13/h2-4,6-7,14-15,20H,5,8-12H2,1H3,(H,18,22).
What are the key properties of 2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide?
2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide has a molecular weight of 304.39 g/mol, XLogP of 1.08, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-phenacylacetamide is sourced from PubChem (CID 109397769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).