1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine

C11H23NO — CID 116724204

IUPAC1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine
SMILESCOC(C(N)CC1CC1)C(C)(C)C
InChIInChI=1S/C11H23NO/c1-11(2,3)10(13-4)9(12)7-8-5-6-8/h8-10H,5-7,12H2,1-4H3
InChIKeyVEIZTCHBIQUVDT-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.17
Rot. Bonds4

About 1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine

1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine (PubChem CID 116724204) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine
PubChem CID116724204
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine
SMILESCOC(C(N)CC1CC1)C(C)(C)C
InChIInChI=1S/C11H23NO/c1-11(2,3)10(13-4)9(12)7-8-5-6-8/h8-10H,5-7,12H2,1-4H3
InChIKeyVEIZTCHBIQUVDT-UHFFFAOYSA-N
XLogP2.17
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-4-methoxy-5,5-dimethylhexan-3-amine
CID 104932286
(1-cyclopentyl-3-methoxy-4,4-dimethylpentan-2-yl)hydrazine
CID 105273349
1-cyclopentyl-3-methoxy-4,4-dimethylpentan-2-ol
CID 116712985
1-(4-tert-butylcyclohexyl)-3-methylbutan-2-amine
CID 104575536
1-cyclobutyl-3-methoxy-N,4,4-trimethylpentan-2-amine
CID 116724473
1-cyclopropyl-3-methoxyhexan-2-amine
CID 116718581
1-cyclopropyl-2-methoxy-3,3-dimethylbutan-1-ol
CID 116713007
1-cyclopropyl-3-methylpentan-2-amine
CID 64904257
3-methoxy-2,2-dimethyloctan-4-amine
CID 116724229
2-methoxy-3,3-dimethyl-1-(3-methylcyclohexyl)butan-1-amine
CID 116724128
1-cyclopropyl-3-fluorobutan-2-amine
CID 84648134
(1-cyclohexyl-2-methoxy-3,3-dimethylbutyl)hydrazine
CID 105273420

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine?
The IUPAC name of 1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine (CID 116724204) is 1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine.
What is the SMILES notation for 1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine?
The canonical SMILES for 1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine is COC(C(N)CC1CC1)C(C)(C)C.
What is the InChIKey of 1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine?
The InChIKey is VEIZTCHBIQUVDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-11(2,3)10(13-4)9(12)7-8-5-6-8/h8-10H,5-7,12H2,1-4H3.
What are the key properties of 1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine?
1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine has a molecular weight of 185.31 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-methoxy-4,4-dimethylpentan-2-amine is sourced from PubChem (CID 116724204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).