N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide

C13H26N2O — CID 119507538

IUPACN-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide
SMILESCCNCCNC(=O)CC1CCCC(C)C1
InChIInChI=1S/C13H26N2O/c1-3-14-7-8-15-13(16)10-12-6-4-5-11(2)9-12/h11-12,14H,3-10H2,1-2H3,(H,15,16)
InChIKeyWYOWJCWRGBLFSR-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.93
Rot. Bonds6

About N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide

N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide (PubChem CID 119507538) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide.

Molecular Properties

Compound NameN-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide
PubChem CID119507538
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide
SMILESCCNCCNC(=O)CC1CCCC(C)C1
InChIInChI=1S/C13H26N2O/c1-3-14-7-8-15-13(16)10-12-6-4-5-11(2)9-12/h11-12,14H,3-10H2,1-2H3,(H,15,16)
InChIKeyWYOWJCWRGBLFSR-UHFFFAOYSA-N
XLogP1.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-cyclopropyl-N-[2-(ethylamino)ethyl]acetamide
CID 62659717
N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide
CID 111463205
ethane;N-ethyl-2-[(1S)-3-methylcyclohexyl]ethanamine
CID 145095472
N-[(1-hydroxycycloheptyl)methyl]-2-[(1S,3S)-3-methylcyclohexyl]acetamide
CID 99809445
1-[(3R)-3-methylcyclohexyl]propan-2-one
CID 130348727
4-cyclopentyl-N-[2-(ethylamino)ethyl]butanamide;hydrochloride
CID 119509622
N-[3-(aminomethyl)pentan-3-yl]-2-(3-methylcyclohexyl)acetamide;hydrochloride
CID 119570689
2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide
CID 78966290
2-(3-aminocyclohexyl)-N-pentylacetamide
CID 62783155
2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride
CID 119783122
2-[(1S,3R)-3-methylcyclohexyl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]acetamide
CID 99793014
2-cycloheptyl-N-[2-(propan-2-ylamino)ethyl]acetamide
CID 114458404

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide?
The IUPAC name of N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide (CID 119507538) is N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide.
What is the SMILES notation for N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide?
The canonical SMILES for N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide is CCNCCNC(=O)CC1CCCC(C)C1.
What is the InChIKey of N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide?
The InChIKey is WYOWJCWRGBLFSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-3-14-7-8-15-13(16)10-12-6-4-5-11(2)9-12/h11-12,14H,3-10H2,1-2H3,(H,15,16).
What are the key properties of N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide?
N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide has a molecular weight of 226.36 g/mol, XLogP of 1.93, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide is sourced from PubChem (CID 119507538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).