2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide

C15H28N2O2 — CID 65052072

IUPAC2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide
SMILESNCC1(OCC(=O)NC2CCCC2)CCCCCC1
InChIInChI=1S/C15H28N2O2/c16-12-15(9-5-1-2-6-10-15)19-11-14(18)17-13-7-3-4-8-13/h13H,1-12,16H2,(H,17,18)
InChIKeyIEOQLMTWGALSHR-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.11
Rot. Bonds5

About 2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide

2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide (PubChem CID 65052072) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide
PubChem CID65052072
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide
SMILESNCC1(OCC(=O)NC2CCCC2)CCCCCC1
InChIInChI=1S/C15H28N2O2/c16-12-15(9-5-1-2-6-10-15)19-11-14(18)17-13-7-3-4-8-13/h13H,1-12,16H2,(H,17,18)
InChIKeyIEOQLMTWGALSHR-UHFFFAOYSA-N
XLogP2.11
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

8-Azaspiro[bicyclo[3.2.1]octane-3,2'-morpholin]-5'-one hydrochloride
CID 91812266
2-[1-(aminomethyl)cycloheptyl]oxy-N-(2,2,2-trifluoroethyl)acetamide
CID 65051374
7,8,9a-trimethyl-4a,5,6,7,8,9-hexahydro-4H-cyclohepta[b][1,4]oxazin-3-one
CID 123227954
6-Methyl-4,4a,5,6,7,8,9,9a-octahydrocyclohepta[b][1,4]oxazin-3-one
CID 164131218
[8-[[2-Methyl-2-(3-methylbutoxy)propanoyl]amino]cyclotetradecyl]methyl cyanate
CID 169988528
N-[(1-hydroxycycloheptyl)methyl]-2-methoxyacetamide
CID 64444665
2-ethoxy-N-[(1-hydroxycycloheptyl)methyl]acetamide
CID 64459719
2-[(1-aminocycloheptyl)methoxy]-N-propylpropanamide
CID 64548740
2-[(1-aminocycloheptyl)methoxy]-N-cyclohexylpropanamide
CID 64548760
2-[(1-aminocycloheptyl)methoxy]-N-propylacetamide
CID 64548960
2-[(1-aminocycloheptyl)methoxy]-N-(cyclopropylmethyl)acetamide
CID 64549146
2-[(1-aminocycloheptyl)methoxy]-N-cyclopropylacetamide
CID 64549148

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide?
The IUPAC name of 2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide (CID 65052072) is 2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide.
What is the SMILES notation for 2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide?
The canonical SMILES for 2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide is NCC1(OCC(=O)NC2CCCC2)CCCCCC1.
What is the InChIKey of 2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide?
The InChIKey is IEOQLMTWGALSHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c16-12-15(9-5-1-2-6-10-15)19-11-14(18)17-13-7-3-4-8-13/h13H,1-12,16H2,(H,17,18).
What are the key properties of 2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide?
2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide has a molecular weight of 268.40 g/mol, XLogP of 2.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide is sourced from PubChem (CID 65052072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).