N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide

C17H32N2O3 — CID 166816681

IUPACN-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide
SMILESO=C(NCCOCCOCCNC1CCCC1)C1CCCC1
InChIInChI=1S/C17H32N2O3/c20-17(15-5-1-2-6-15)19-10-12-22-14-13-21-11-9-18-16-7-3-4-8-16/h15-16,18H,1-14H2,(H,19,20)
InChIKeyRVMBXVNJRJNIHR-UHFFFAOYSA-N
MW312.45 g/mol
LogP1.86
Rot. Bonds11

About N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide

N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide (PubChem CID 166816681) has the molecular formula C17H32N2O3 and a molecular weight of 312.45 g/mol. Its IUPAC name is N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide
PubChem CID166816681
Molecular FormulaC17H32N2O3
Molecular Weight312.45 g/mol
Exact Mass312.24
IUPAC NameN-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide
SMILESO=C(NCCOCCOCCNC1CCCC1)C1CCCC1
InChIInChI=1S/C17H32N2O3/c20-17(15-5-1-2-6-15)19-10-12-22-14-13-21-11-9-18-16-7-3-4-8-16/h15-16,18H,1-14H2,(H,19,20)
InChIKeyRVMBXVNJRJNIHR-UHFFFAOYSA-N
XLogP1.86
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.45
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[2-[2-[3-[2-[2-(cycloheptylamino)ethoxy]ethoxy]propanoylamino]ethoxy]ethoxy]ethyl]cyclopentanecarboxamide
CID 166816782
N-[2-[2-(dimethylamino)ethoxy]ethyl]cyclohexanecarboxamide
CID 176960465
N-[12-(cyclohexylamino)dodecyl]cyclopentanecarboxamide
CID 146474949
N-[12-(cycloheptylamino)dodecyl]cyclohexanecarboxamide
CID 166816734
N-[3-(cyclopentylamino)propyl]cyclobutanecarboxamide;hydrochloride
CID 115676200
2-[2-(cycloheptylamino)ethoxy]acetic acid
CID 82934150
N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide
CID 140689700
N-[2-[2-[3-(2-methylidenehydrazinyl)-3-oxopropoxy]ethoxy]ethyl]cyclotridecanecarboxamide
CID 135141214
N-[3-(2-bromoethoxy)propyl]cycloheptanecarboxamide
CID 106307600
2-[2-(cyclohexylamino)ethoxy]ethanol
CID 3361598
ethane;N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-methylcyclohexane-1-carboxamide
CID 177357452
N-[2-(3,5-dimethylphenoxy)ethyl]cyclohexanecarboxamide
CID 2994102

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide?
The IUPAC name of N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide (CID 166816681) is N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide?
The canonical SMILES for N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide is O=C(NCCOCCOCCNC1CCCC1)C1CCCC1.
What is the InChIKey of N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide?
The InChIKey is RVMBXVNJRJNIHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O3/c20-17(15-5-1-2-6-15)19-10-12-22-14-13-21-11-9-18-16-7-3-4-8-16/h15-16,18H,1-14H2,(H,19,20).
What are the key properties of N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide?
N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide has a molecular weight of 312.45 g/mol, XLogP of 1.86, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide is sourced from PubChem (CID 166816681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).