1-methoxy-N,2,4,4-tetramethylpentan-2-amine

C10H23NO — CID 134290101

IUPAC1-methoxy-N,2,4,4-tetramethylpentan-2-amine
SMILESCNC(C)(COC)CC(C)(C)C
InChIInChI=1S/C10H23NO/c1-9(2,3)7-10(4,11-5)8-12-6/h11H,7-8H2,1-6H3
InChIKeyXNAVMFCDAFWKLG-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.05
Rot. Bonds4

About 1-methoxy-N,2,4,4-tetramethylpentan-2-amine

1-methoxy-N,2,4,4-tetramethylpentan-2-amine (PubChem CID 134290101) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 1-methoxy-N,2,4,4-tetramethylpentan-2-amine.

Molecular Properties

Compound Name1-methoxy-N,2,4,4-tetramethylpentan-2-amine
PubChem CID134290101
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name1-methoxy-N,2,4,4-tetramethylpentan-2-amine
SMILESCNC(C)(COC)CC(C)(C)C
InChIInChI=1S/C10H23NO/c1-9(2,3)7-10(4,11-5)8-12-6/h11H,7-8H2,1-6H3
InChIKeyXNAVMFCDAFWKLG-UHFFFAOYSA-N
XLogP2.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N,2,4,4-tetramethylpentan-2-amine?
The IUPAC name of 1-methoxy-N,2,4,4-tetramethylpentan-2-amine (CID 134290101) is 1-methoxy-N,2,4,4-tetramethylpentan-2-amine.
What is the SMILES notation for 1-methoxy-N,2,4,4-tetramethylpentan-2-amine?
The canonical SMILES for 1-methoxy-N,2,4,4-tetramethylpentan-2-amine is CNC(C)(COC)CC(C)(C)C.
What is the InChIKey of 1-methoxy-N,2,4,4-tetramethylpentan-2-amine?
The InChIKey is XNAVMFCDAFWKLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-9(2,3)7-10(4,11-5)8-12-6/h11H,7-8H2,1-6H3.
What are the key properties of 1-methoxy-N,2,4,4-tetramethylpentan-2-amine?
1-methoxy-N,2,4,4-tetramethylpentan-2-amine has a molecular weight of 173.30 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N,2,4,4-tetramethylpentan-2-amine is sourced from PubChem (CID 134290101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).