N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide

C17H26N2O2 — CID 63753347

IUPACN-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide
SMILESCOC(C(=O)N(CCN)C1CCCCC1)c1ccccc1
InChIInChI=1S/C17H26N2O2/c1-21-16(14-8-4-2-5-9-14)17(20)19(13-12-18)15-10-6-3-7-11-15/h2,4-5,8-9,15-16H,3,6-7,10-13,18H2,1H3
InChIKeyRLZDYXDRMGNCBV-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.49
Rot. Bonds6

About N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide

N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide (PubChem CID 63753347) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide
PubChem CID63753347
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide
SMILESCOC(C(=O)N(CCN)C1CCCCC1)c1ccccc1
InChIInChI=1S/C17H26N2O2/c1-21-16(14-8-4-2-5-9-14)17(20)19(13-12-18)15-10-6-3-7-11-15/h2,4-5,8-9,15-16H,3,6-7,10-13,18H2,1H3
InChIKeyRLZDYXDRMGNCBV-UHFFFAOYSA-N
XLogP2.49
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide?
The IUPAC name of N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide (CID 63753347) is N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide.
What is the SMILES notation for N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide?
The canonical SMILES for N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide is COC(C(=O)N(CCN)C1CCCCC1)c1ccccc1.
What is the InChIKey of N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide?
The InChIKey is RLZDYXDRMGNCBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-21-16(14-8-4-2-5-9-14)17(20)19(13-12-18)15-10-6-3-7-11-15/h2,4-5,8-9,15-16H,3,6-7,10-13,18H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide?
N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide has a molecular weight of 290.41 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-cyclohexyl-2-methoxy-2-phenylacetamide is sourced from PubChem (CID 63753347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).