4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine

C10H23NO2 — CID 103028572

IUPAC4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine
SMILESCOC(C)(C)CC(N)COC(C)C
InChIInChI=1S/C10H23NO2/c1-8(2)13-7-9(11)6-10(3,4)12-5/h8-9H,6-7,11H2,1-5H3
InChIKeyKVGGIBOYWSQJFM-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.55
Rot. Bonds6

About 4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine

4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine (PubChem CID 103028572) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine.

Molecular Properties

Compound Name4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine
PubChem CID103028572
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine
SMILESCOC(C)(C)CC(N)COC(C)C
InChIInChI=1S/C10H23NO2/c1-8(2)13-7-9(11)6-10(3,4)12-5/h8-9H,6-7,11H2,1-5H3
InChIKeyKVGGIBOYWSQJFM-UHFFFAOYSA-N
XLogP1.55
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine?
The IUPAC name of 4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine (CID 103028572) is 4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine.
What is the SMILES notation for 4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine?
The canonical SMILES for 4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine is COC(C)(C)CC(N)COC(C)C.
What is the InChIKey of 4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine?
The InChIKey is KVGGIBOYWSQJFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-8(2)13-7-9(11)6-10(3,4)12-5/h8-9H,6-7,11H2,1-5H3.
What are the key properties of 4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine?
4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine has a molecular weight of 189.30 g/mol, XLogP of 1.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-4-methyl-1-propan-2-yloxypentan-2-amine is sourced from PubChem (CID 103028572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).