N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide

C16H30N2O2 — CID 119339952

IUPACN-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide
SMILESCCOCCC1(CNC(=O)C2CCCNC2)CCCC1
InChIInChI=1S/C16H30N2O2/c1-2-20-11-9-16(7-3-4-8-16)13-18-15(19)14-6-5-10-17-12-14/h14,17H,2-13H2,1H3,(H,18,19)
InChIKeyOSOYOTJVLRITOJ-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.09
Rot. Bonds7

About N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide

N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide (PubChem CID 119339952) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide
PubChem CID119339952
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC NameN-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide
SMILESCCOCCC1(CNC(=O)C2CCCNC2)CCCC1
InChIInChI=1S/C16H30N2O2/c1-2-20-11-9-16(7-3-4-8-16)13-18-15(19)14-6-5-10-17-12-14/h14,17H,2-13H2,1H3,(H,18,19)
InChIKeyOSOYOTJVLRITOJ-UHFFFAOYSA-N
XLogP2.09
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119820344
N-[(1-ethylcyclopentyl)methyl]piperidine-3-carboxamide
CID 103797871
N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-3-carboxamide
CID 119820405
(3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide
CID 104969411
(2S,4S)-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpiperidine-4-carboxamide
CID 120638797
2-[1-[[[(3S)-piperidine-3-carbonyl]amino]methyl]cyclobutyl]acetic acid
CID 81161187
N-[(1-ethylcyclobutyl)methyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119782174
2-[[1-(2-ethoxyethyl)cyclopentyl]methylcarbamoyl]cyclobutane-1-carboxylic acid
CID 120977017
9-amino-N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120992642
N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852
(3R)-N-[(1-hydroxycyclobutyl)methyl]piperidine-3-carboxamide
CID 104874196
(3R)-N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]piperidine-3-carboxamide
CID 81133718

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide?
The IUPAC name of N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide (CID 119339952) is N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide?
The canonical SMILES for N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide is CCOCCC1(CNC(=O)C2CCCNC2)CCCC1.
What is the InChIKey of N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide?
The InChIKey is OSOYOTJVLRITOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-2-20-11-9-16(7-3-4-8-16)13-18-15(19)14-6-5-10-17-12-14/h14,17H,2-13H2,1H3,(H,18,19).
What are the key properties of N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide?
N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide has a molecular weight of 282.43 g/mol, XLogP of 2.09, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide is sourced from PubChem (CID 119339952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).