N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide

C23H30N2O3 — CID 75384124

IUPACN-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)NC1CCN(C2CCCCC2O)CC1
InChIInChI=1S/C23H30N2O3/c26-22-8-4-3-7-21(22)25-13-11-19(12-14-25)24-23(27)16-28-20-10-9-17-5-1-2-6-18(17)15-20/h1-2,5-6,9-10,15,19,21-22,26H,3-4,7-8,11-14,16H2,(H,24,27)
InChIKeyPRKYWVZXCQKESV-UHFFFAOYSA-N
MW382.50 g/mol
LogP3.10
Rot. Bonds5

About N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide

N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide (PubChem CID 75384124) has the molecular formula C23H30N2O3 and a molecular weight of 382.50 g/mol. Its IUPAC name is N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide
PubChem CID75384124
Molecular FormulaC23H30N2O3
Molecular Weight382.50 g/mol
Exact Mass382.23
IUPAC NameN-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)NC1CCN(C2CCCCC2O)CC1
InChIInChI=1S/C23H30N2O3/c26-22-8-4-3-7-21(22)25-13-11-19(12-14-25)24-23(27)16-28-20-10-9-17-5-1-2-6-18(17)15-20/h1-2,5-6,9-10,15,19,21-22,26H,3-4,7-8,11-14,16H2,(H,24,27)
InChIKeyPRKYWVZXCQKESV-UHFFFAOYSA-N
XLogP3.10
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.50
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide (CID 75384124) is N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide is O=C(COc1ccc2ccccc2c1)NC1CCN(C2CCCCC2O)CC1.
What is the InChIKey of N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide?
The InChIKey is PRKYWVZXCQKESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O3/c26-22-8-4-3-7-21(22)25-13-11-19(12-14-25)24-23(27)16-28-20-10-9-17-5-1-2-6-18(17)15-20/h1-2,5-6,9-10,15,19,21-22,26H,3-4,7-8,11-14,16H2,(H,24,27).
What are the key properties of N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide?
N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide has a molecular weight of 382.50 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 75384124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).