N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide

C20H32N2O3 — CID 67302294

IUPACN-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide
SMILESCC(=O)NC(C)CCC1CCC(Oc2ccc(OC(C)C)nc2)CC1
InChIInChI=1S/C20H32N2O3/c1-14(2)24-20-12-11-19(13-21-20)25-18-9-7-17(8-10-18)6-5-15(3)22-16(4)23/h11-15,17-18H,5-10H2,1-4H3,(H,22,23)
InChIKeyBGSSITZNPKHFTP-UHFFFAOYSA-N
MW348.49 g/mol
LogP4.11
Rot. Bonds8

About N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide

N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide (PubChem CID 67302294) has the molecular formula C20H32N2O3 and a molecular weight of 348.49 g/mol. Its IUPAC name is N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide.

Molecular Properties

Compound NameN-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide
PubChem CID67302294
Molecular FormulaC20H32N2O3
Molecular Weight348.49 g/mol
Exact Mass348.24
IUPAC NameN-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide
SMILESCC(=O)NC(C)CCC1CCC(Oc2ccc(OC(C)C)nc2)CC1
InChIInChI=1S/C20H32N2O3/c1-14(2)24-20-12-11-19(13-21-20)25-18-9-7-17(8-10-18)6-5-15(3)22-16(4)23/h11-15,17-18H,5-10H2,1-4H3,(H,22,23)
InChIKeyBGSSITZNPKHFTP-UHFFFAOYSA-N
XLogP4.11
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.49
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide?
The IUPAC name of N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide (CID 67302294) is N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide.
What is the SMILES notation for N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide?
The canonical SMILES for N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide is CC(=O)NC(C)CCC1CCC(Oc2ccc(OC(C)C)nc2)CC1.
What is the InChIKey of N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide?
The InChIKey is BGSSITZNPKHFTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O3/c1-14(2)24-20-12-11-19(13-21-20)25-18-9-7-17(8-10-18)6-5-15(3)22-16(4)23/h11-15,17-18H,5-10H2,1-4H3,(H,22,23).
What are the key properties of N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide?
N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide has a molecular weight of 348.49 g/mol, XLogP of 4.11, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[(6-propan-2-yloxy-3-pyridinyl)oxy]cyclohexyl]butan-2-yl]acetamide is sourced from PubChem (CID 67302294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).