N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide

C12H23NO3 — CID 103280773

IUPACN-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide
SMILESCOC(C)CCC(=O)NCC1CCC(O)C1
InChIInChI=1S/C12H23NO3/c1-9(16-2)3-6-12(15)13-8-10-4-5-11(14)7-10/h9-11,14H,3-8H2,1-2H3,(H,13,15)
InChIKeyNEANHQLXUHSKOF-UHFFFAOYSA-N
MW229.32 g/mol
LogP1.08
Rot. Bonds6

About N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide

N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide (PubChem CID 103280773) has the molecular formula C12H23NO3 and a molecular weight of 229.32 g/mol. Its IUPAC name is N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide.

Molecular Properties

Compound NameN-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide
PubChem CID103280773
Molecular FormulaC12H23NO3
Molecular Weight229.32 g/mol
Exact Mass229.17
IUPAC NameN-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide
SMILESCOC(C)CCC(=O)NCC1CCC(O)C1
InChIInChI=1S/C12H23NO3/c1-9(16-2)3-6-12(15)13-8-10-4-5-11(14)7-10/h9-11,14H,3-8H2,1-2H3,(H,13,15)
InChIKeyNEANHQLXUHSKOF-UHFFFAOYSA-N
XLogP1.08
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide?
The IUPAC name of N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide (CID 103280773) is N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide.
What is the SMILES notation for N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide?
The canonical SMILES for N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide is COC(C)CCC(=O)NCC1CCC(O)C1.
What is the InChIKey of N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide?
The InChIKey is NEANHQLXUHSKOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3/c1-9(16-2)3-6-12(15)13-8-10-4-5-11(14)7-10/h9-11,14H,3-8H2,1-2H3,(H,13,15).
What are the key properties of N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide?
N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide has a molecular weight of 229.32 g/mol, XLogP of 1.08, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide is sourced from PubChem (CID 103280773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).