5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol

C12H25NO2 — CID 103905399

IUPAC5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol
SMILESCOCC(NCCCC(C)CO)C1CC1
InChIInChI=1S/C12H25NO2/c1-10(8-14)4-3-7-13-12(9-15-2)11-5-6-11/h10-14H,3-9H2,1-2H3
InChIKeyHIVUJOGLUJUXTH-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.41
Rot. Bonds9

About 5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol

5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol (PubChem CID 103905399) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol.

Molecular Properties

Compound Name5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol
PubChem CID103905399
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol
SMILESCOCC(NCCCC(C)CO)C1CC1
InChIInChI=1S/C12H25NO2/c1-10(8-14)4-3-7-13-12(9-15-2)11-5-6-11/h10-14H,3-9H2,1-2H3
InChIKeyHIVUJOGLUJUXTH-UHFFFAOYSA-N
XLogP1.41
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.41
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

5-(4-methoxybutan-2-ylamino)-2-methylpentan-1-ol
CID 103905392
N-(1-cyclopropyl-2-methoxyethyl)-5,5-dimethylhexan-1-amine
CID 115716677
N-(1-cyclopropyl-2-methoxyethyl)-4-methylsulfanylbutan-1-amine
CID 115721624
N-(1-cyclopropyl-2-methoxyethyl)-5-methylsulfanylpentan-1-amine
CID 104926339
(2S)-2-[(1-cyclopropyl-2-methoxyethyl)amino]butan-1-ol
CID 104981008
5-(1,1-dimethoxypropan-2-ylamino)-2-methylpentan-1-ol
CID 106158376
5-(4-methoxybutylamino)-2-methylpentan-1-ol
CID 106160167
[1-[[(1-cyclopropyl-2-methoxyethyl)amino]methyl]cyclopropyl]methanol
CID 81343057
5-[[cyclopropyl-(4-methylphenyl)methyl]amino]-2-methylpentan-1-ol
CID 103911492
5-[2-(3-methoxypropoxy)ethylamino]-2-methylpentan-1-ol
CID 106160068
5-[(2-methoxy-1-phenylethyl)amino]-2-methylpentan-1-ol
CID 106157424
N-cyclohexyl-2-[(5-hydroxy-4-methylpentyl)amino]propanamide
CID 106160233

Frequently Asked Questions

What is the IUPAC name of 5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol?
The IUPAC name of 5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol (CID 103905399) is 5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol.
What is the SMILES notation for 5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol?
The canonical SMILES for 5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol is COCC(NCCCC(C)CO)C1CC1.
What is the InChIKey of 5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol?
The InChIKey is HIVUJOGLUJUXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-10(8-14)4-3-7-13-12(9-15-2)11-5-6-11/h10-14H,3-9H2,1-2H3.
What are the key properties of 5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol?
5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol has a molecular weight of 215.34 g/mol, XLogP of 1.41, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1-cyclopropyl-2-methoxyethyl)amino]-2-methylpentan-1-ol is sourced from PubChem (CID 103905399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).