N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide

C15H30N2O2 — CID 86848639

IUPACN-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide
SMILESCCOCCCC(=O)NCCN(C)C1CCCCC1
InChIInChI=1S/C15H30N2O2/c1-3-19-13-7-10-15(18)16-11-12-17(2)14-8-5-4-6-9-14/h14H,3-13H2,1-2H3,(H,16,18)
InChIKeyRNNAXXICAWFXDT-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.18
Rot. Bonds9

About N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide

N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide (PubChem CID 86848639) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide.

Molecular Properties

Compound NameN-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide
PubChem CID86848639
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide
SMILESCCOCCCC(=O)NCCN(C)C1CCCCC1
InChIInChI=1S/C15H30N2O2/c1-3-19-13-7-10-15(18)16-11-12-17(2)14-8-5-4-6-9-14/h14H,3-13H2,1-2H3,(H,16,18)
InChIKeyRNNAXXICAWFXDT-UHFFFAOYSA-N
XLogP2.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.18
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

N-[2-[cyclohexyl(methyl)amino]ethyl]pentanamide
CID 86848662
4-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]butanamide
CID 63316373
4-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]butanamide;dihydrochloride
CID 119878781
N-[2-(cycloheptylamino)ethyl]-4-ethoxybutanamide;hydrochloride
CID 119619598
N-[2-[2-[cyclohexyl(methyl)amino]ethylamino]-2-oxoethyl]propanamide
CID 86849216
6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide
CID 60981769
3-(tert-butylamino)-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide
CID 63315852
N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide
CID 63903373
ethane;N-(2-ethoxyethyl)-N-methylcyclobutanamine
CID 176920815
2-(2-aminoethoxy)-N-[3-[cyclohexyl(methyl)amino]propyl]acetamide
CID 79473004
4-ethoxy-N-(2-hydroxyethyl)butanamide
CID 112728032
N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide
CID 59205256

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide?
The IUPAC name of N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide (CID 86848639) is N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide.
What is the SMILES notation for N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide?
The canonical SMILES for N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide is CCOCCCC(=O)NCCN(C)C1CCCCC1.
What is the InChIKey of N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide?
The InChIKey is RNNAXXICAWFXDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-3-19-13-7-10-15(18)16-11-12-17(2)14-8-5-4-6-9-14/h14H,3-13H2,1-2H3,(H,16,18).
What are the key properties of N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide?
N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide has a molecular weight of 270.42 g/mol, XLogP of 2.18, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide is sourced from PubChem (CID 86848639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).