2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide

C16H24N2O3 — CID 106871777

IUPAC2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide
SMILESCOCC(=O)Nc1ccc(NC2CCCC(OC)C2)cc1
InChIInChI=1S/C16H24N2O3/c1-20-11-16(19)18-13-8-6-12(7-9-13)17-14-4-3-5-15(10-14)21-2/h6-9,14-15,17H,3-5,10-11H2,1-2H3,(H,18,19)
InChIKeyQUEYEZWUIYANNU-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.64
Rot. Bonds6

About 2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide

2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide (PubChem CID 106871777) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide
PubChem CID106871777
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide
SMILESCOCC(=O)Nc1ccc(NC2CCCC(OC)C2)cc1
InChIInChI=1S/C16H24N2O3/c1-20-11-16(19)18-13-8-6-12(7-9-13)17-14-4-3-5-15(10-14)21-2/h6-9,14-15,17H,3-5,10-11H2,1-2H3,(H,18,19)
InChIKeyQUEYEZWUIYANNU-UHFFFAOYSA-N
XLogP2.64
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide?
The IUPAC name of 2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide (CID 106871777) is 2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide?
The canonical SMILES for 2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide is COCC(=O)Nc1ccc(NC2CCCC(OC)C2)cc1.
What is the InChIKey of 2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide?
The InChIKey is QUEYEZWUIYANNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-20-11-16(19)18-13-8-6-12(7-9-13)17-14-4-3-5-15(10-14)21-2/h6-9,14-15,17H,3-5,10-11H2,1-2H3,(H,18,19).
What are the key properties of 2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide?
2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide has a molecular weight of 292.38 g/mol, XLogP of 2.64, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[4-[(3-methoxycyclohexyl)amino]phenyl]acetamide is sourced from PubChem (CID 106871777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).