2-methoxy-2,6-dimethylheptan-4-amine

C10H23NO — CID 103024825

IUPAC2-methoxy-2,6-dimethylheptan-4-amine
SMILESCOC(C)(C)CC(N)CC(C)C
InChIInChI=1S/C10H23NO/c1-8(2)6-9(11)7-10(3,4)12-5/h8-9H,6-7,11H2,1-5H3
InChIKeyYIPITUGAPFVJHR-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.17
Rot. Bonds5

About 2-methoxy-2,6-dimethylheptan-4-amine

2-methoxy-2,6-dimethylheptan-4-amine (PubChem CID 103024825) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 2-methoxy-2,6-dimethylheptan-4-amine.

Molecular Properties

Compound Name2-methoxy-2,6-dimethylheptan-4-amine
PubChem CID103024825
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name2-methoxy-2,6-dimethylheptan-4-amine
SMILESCOC(C)(C)CC(N)CC(C)C
InChIInChI=1S/C10H23NO/c1-8(2)6-9(11)7-10(3,4)12-5/h8-9H,6-7,11H2,1-5H3
InChIKeyYIPITUGAPFVJHR-UHFFFAOYSA-N
XLogP2.17
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2,6,6-Tetramethyloxan-4-amine
CID 69672274
1,1,1-Trifluoro-6-methoxy-6-methylheptan-4-amine
CID 103027354
1-(3,3-Dimethyloxiran-2-yl)-3-methylbutan-1-amine
CID 53805989
(3R)-1-methoxy-5-methylhexan-3-amine
CID 57790336
(3R)-1-ethoxy-5-methylhexan-3-amine
CID 57791000
(3S)-1-ethoxy-5-methylhexan-3-amine
CID 57791061
(3S)-1-methoxy-5-methylhexan-3-amine
CID 57791170
(4R)-2-methoxy-2-methylheptan-4-amine
CID 59383057
1-Methoxy-5-methylhexan-3-amine
CID 61412922
6-Methoxy-6-methylheptan-2-amine
CID 86043672
8-Methoxy-4,8-dimethylnonan-1-amine
CID 88258649
2-Methoxy-6-methylheptan-4-amine
CID 104170586

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2,6-dimethylheptan-4-amine?
The IUPAC name of 2-methoxy-2,6-dimethylheptan-4-amine (CID 103024825) is 2-methoxy-2,6-dimethylheptan-4-amine.
What is the SMILES notation for 2-methoxy-2,6-dimethylheptan-4-amine?
The canonical SMILES for 2-methoxy-2,6-dimethylheptan-4-amine is COC(C)(C)CC(N)CC(C)C.
What is the InChIKey of 2-methoxy-2,6-dimethylheptan-4-amine?
The InChIKey is YIPITUGAPFVJHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-8(2)6-9(11)7-10(3,4)12-5/h8-9H,6-7,11H2,1-5H3.
What are the key properties of 2-methoxy-2,6-dimethylheptan-4-amine?
2-methoxy-2,6-dimethylheptan-4-amine has a molecular weight of 173.30 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2,6-dimethylheptan-4-amine is sourced from PubChem (CID 103024825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).