N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide

C16H28N2O3 — CID 109145922

IUPACN-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide
SMILESCOCCNC(=O)C1CCC(C(=O)N2CCCCC2)CC1
InChIInChI=1S/C16H28N2O3/c1-21-12-9-17-15(19)13-5-7-14(8-6-13)16(20)18-10-3-2-4-11-18/h13-14H,2-12H2,1H3,(H,17,19)
InChIKeyVVYNSOSGPPPYMF-UHFFFAOYSA-N
MW296.41 g/mol
LogP1.57
Rot. Bonds5

About N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide

N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide (PubChem CID 109145922) has the molecular formula C16H28N2O3 and a molecular weight of 296.41 g/mol. Its IUPAC name is N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide
PubChem CID109145922
Molecular FormulaC16H28N2O3
Molecular Weight296.41 g/mol
Exact Mass296.21
IUPAC NameN-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide
SMILESCOCCNC(=O)C1CCC(C(=O)N2CCCCC2)CC1
InChIInChI=1S/C16H28N2O3/c1-21-12-9-17-15(19)13-5-7-14(8-6-13)16(20)18-10-3-2-4-11-18/h13-14H,2-12H2,1H3,(H,17,19)
InChIKeyVVYNSOSGPPPYMF-UHFFFAOYSA-N
XLogP1.57
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide
CID 113003322
N-(2-methoxyethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
CID 51072787
N-(2-methoxyethyl)-1-pyrrolidin-1-ylsulfonylpiperidine-4-carboxamide
CID 5058959
4-N-(2-methoxyethyl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
CID 3543766
1-N-cyclopropyl-4-N-(2-methoxyethyl)piperidine-1,4-dicarboxamide
CID 47151765
N-(3-methoxypropyl)cyclopropanecarboxamide
CID 5052597
N-[2-(2-methoxyethylamino)ethyl]cycloheptanecarboxamide
CID 82994613
N-[2-[[N-(2-methoxyethyl)-N'-methylcarbamimidoyl]amino]ethyl]cyclopropanecarboxamide
CID 110940168
1-(cyclohexanecarbonylamino)-3-(2-methoxyethyl)thiourea
CID 17373263
N-[2-(cyclopropanecarbonylamino)ethyl]azocane-1-carboxamide
CID 71940931
N-[2-(cyclopropanecarbonylamino)ethyl]azepane-1-carboxamide
CID 113223981
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109145625

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide (CID 109145922) is N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide is COCCNC(=O)C1CCC(C(=O)N2CCCCC2)CC1.
What is the InChIKey of N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide?
The InChIKey is VVYNSOSGPPPYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O3/c1-21-12-9-17-15(19)13-5-7-14(8-6-13)16(20)18-10-3-2-4-11-18/h13-14H,2-12H2,1H3,(H,17,19).
What are the key properties of N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide?
N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide has a molecular weight of 296.41 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 109145922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).