2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide

C15H28N2O2 — CID 114467920

IUPAC2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide
SMILESC=C(C)COCCNC(=O)CC1(NC)CCCCC1
InChIInChI=1S/C15H28N2O2/c1-13(2)12-19-10-9-17-14(18)11-15(16-3)7-5-4-6-8-15/h16H,1,4-12H2,2-3H3,(H,17,18)
InChIKeyUVXNRXQZSDUCQO-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.01
Rot. Bonds8

About 2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide

2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide (PubChem CID 114467920) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide.

Molecular Properties

Compound Name2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide
PubChem CID114467920
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide
SMILESC=C(C)COCCNC(=O)CC1(NC)CCCCC1
InChIInChI=1S/C15H28N2O2/c1-13(2)12-19-10-9-17-14(18)11-15(16-3)7-5-4-6-8-15/h16H,1,4-12H2,2-3H3,(H,17,18)
InChIKeyUVXNRXQZSDUCQO-UHFFFAOYSA-N
XLogP2.01
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4,4-difluoro-N-[2-(2-methylprop-2-enoxy)ethyl]cyclohexane-1-carboxamide
CID 113340448
3-cyclohexyl-N-[3,3-dimethyl-1-(2-methylprop-2-enoxy)butan-2-yl]propanamide;molecular hydrogen
CID 145466061
2-(1-aminocyclohexyl)-N-(1-methoxybutan-2-yl)acetamide
CID 64677487
2-(1-aminocyclohexyl)-N-(2-butoxyethyl)acetamide
CID 64677989
2-(1-aminocyclohexyl)-N-[2-(3-methylbutoxy)ethyl]acetamide
CID 64679044
2-(1-aminocyclohexyl)-N-(1-ethoxypropan-2-yl)acetamide
CID 64679248
2-(1-aminocyclohexyl)-N-[2-(2-methoxyethoxy)ethyl]acetamide
CID 64679666
2-(1-aminocyclohexyl)-N-(2-ethoxyethyl)acetamide
CID 64684196
2-(1-aminocyclohexyl)-N-(1-methoxypropan-2-yl)acetamide
CID 64685321
2-(1-aminocyclohexyl)-N-(2-methoxyethyl)acetamide
CID 64686297
N-(1-methoxypropan-2-yl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 65240718
N-(2-methoxyethyl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 65240813

Frequently Asked Questions

What is the IUPAC name of 2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide?
The IUPAC name of 2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide (CID 114467920) is 2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide.
What is the SMILES notation for 2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide?
The canonical SMILES for 2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide is C=C(C)COCCNC(=O)CC1(NC)CCCCC1.
What is the InChIKey of 2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide?
The InChIKey is UVXNRXQZSDUCQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-13(2)12-19-10-9-17-14(18)11-15(16-3)7-5-4-6-8-15/h16H,1,4-12H2,2-3H3,(H,17,18).
What are the key properties of 2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide?
2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide has a molecular weight of 268.40 g/mol, XLogP of 2.01, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide is sourced from PubChem (CID 114467920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).