N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide

C16H32N2O2 — CID 115592406

IUPACN-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide
SMILESCOCCNC(=O)CCNC1CC(C)CCC1C(C)C
InChIInChI=1S/C16H32N2O2/c1-12(2)14-6-5-13(3)11-15(14)17-8-7-16(19)18-9-10-20-4/h12-15,17H,5-11H2,1-4H3,(H,18,19)
InChIKeyZCQWEOODYMLKGE-UHFFFAOYSA-N
MW284.44 g/mol
LogP2.19
Rot. Bonds8

About N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide

N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide (PubChem CID 115592406) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide
PubChem CID115592406
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC NameN-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide
SMILESCOCCNC(=O)CCNC1CC(C)CCC1C(C)C
InChIInChI=1S/C16H32N2O2/c1-12(2)14-6-5-13(3)11-15(14)17-8-7-16(19)18-9-10-20-4/h12-15,17H,5-11H2,1-4H3,(H,18,19)
InChIKeyZCQWEOODYMLKGE-UHFFFAOYSA-N
XLogP2.19
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 52.19
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-(2-methoxyethyl)-3-[(3-methylcyclopentyl)amino]propanamide
CID 115652663
1-(3-methoxypropyl)-3-(5-methyl-2-propan-2-ylcyclohexyl)urea
CID 91447915
3-[(1,2-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)propanamide
CID 112700219
N-(2-methoxyethyl)-3-[[3-oxo-3-(propan-2-ylamino)propyl]amino]propanamide
CID 113410009
6-[(5-methyl-2-propan-2-ylcyclohexyl)amino]hexan-1-ol
CID 103922216
N-heptyl-5-methyl-2-propan-2-ylcyclohexan-1-amine
CID 43223218
(2R)-1-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propan-2-ol
CID 103906936
2-methoxy-N-(5-methyl-2-propan-2-ylcyclohexyl)propanamide
CID 113225650
3-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide
CID 112700222
3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(2-methoxyethyl)propanamide
CID 112701684
3-(1-cyclopentylethylamino)-N-(2-methoxyethyl)propanamide
CID 112700250
5-methyl-N-(3-methylsulfinylpropyl)-2-propan-2-ylcyclohexan-1-amine
CID 113261734

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide?
The IUPAC name of N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide (CID 115592406) is N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide.
What is the SMILES notation for N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide?
The canonical SMILES for N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide is COCCNC(=O)CCNC1CC(C)CCC1C(C)C.
What is the InChIKey of N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide?
The InChIKey is ZCQWEOODYMLKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-12(2)14-6-5-13(3)11-15(14)17-8-7-16(19)18-9-10-20-4/h12-15,17H,5-11H2,1-4H3,(H,18,19).
What are the key properties of N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide?
N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide has a molecular weight of 284.44 g/mol, XLogP of 2.19, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide is sourced from PubChem (CID 115592406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).