N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide

C14H24N2O3 — CID 43427967

IUPACN-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide
SMILESO=C(NCCC(=O)N1CCC(O)CC1)C1CCCC1
InChIInChI=1S/C14H24N2O3/c17-12-6-9-16(10-7-12)13(18)5-8-15-14(19)11-3-1-2-4-11/h11-12,17H,1-10H2,(H,15,19)
InChIKeyNSXQYYQGQRQTDJ-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.67
Rot. Bonds4

About N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide

N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide (PubChem CID 43427967) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide
PubChem CID43427967
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC NameN-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide
SMILESO=C(NCCC(=O)N1CCC(O)CC1)C1CCCC1
InChIInChI=1S/C14H24N2O3/c17-12-6-9-16(10-7-12)13(18)5-8-15-14(19)11-3-1-2-4-11/h11-12,17H,1-10H2,(H,15,19)
InChIKeyNSXQYYQGQRQTDJ-UHFFFAOYSA-N
XLogP0.67
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide?
The IUPAC name of N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide (CID 43427967) is N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide?
The canonical SMILES for N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide is O=C(NCCC(=O)N1CCC(O)CC1)C1CCCC1.
What is the InChIKey of N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide?
The InChIKey is NSXQYYQGQRQTDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c17-12-6-9-16(10-7-12)13(18)5-8-15-14(19)11-3-1-2-4-11/h11-12,17H,1-10H2,(H,15,19).
What are the key properties of N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide?
N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide has a molecular weight of 268.36 g/mol, XLogP of 0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]cyclopentanecarboxamide is sourced from PubChem (CID 43427967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).