6-methoxy-3,6-dimethylheptan-1-amine

C10H23NO — CID 103019673

IUPAC6-methoxy-3,6-dimethylheptan-1-amine
SMILESCOC(C)(C)CCC(C)CCN
InChIInChI=1S/C10H23NO/c1-9(6-8-11)5-7-10(2,3)12-4/h9H,5-8,11H2,1-4H3
InChIKeyJZFRPLKGWQDEPR-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.18
Rot. Bonds6

About 6-methoxy-3,6-dimethylheptan-1-amine

6-methoxy-3,6-dimethylheptan-1-amine (PubChem CID 103019673) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 6-methoxy-3,6-dimethylheptan-1-amine.

Molecular Properties

Compound Name6-methoxy-3,6-dimethylheptan-1-amine
PubChem CID103019673
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name6-methoxy-3,6-dimethylheptan-1-amine
SMILESCOC(C)(C)CCC(C)CCN
InChIInChI=1S/C10H23NO/c1-9(6-8-11)5-7-10(2,3)12-4/h9H,5-8,11H2,1-4H3
InChIKeyJZFRPLKGWQDEPR-UHFFFAOYSA-N
XLogP2.18
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-methoxy-3,7-dimethyloctan-1-amine
CID 102547373
(3-methoxy-3-methylbutyl) 4-amino-2-methylbutanoate
CID 106666034
4-(3-methoxy-3-methylbutoxy)pentan-1-amine
CID 106667811
(2E,4E)-10-methoxy-2,7,10-trimethylundeca-2,4-dien-1-amine
CID 88844803
5-methoxy-5-methyl-2-propylhexan-1-amine
CID 103036614
6-bromo-2-methoxy-2,5-dimethylheptane
CID 103036506
2,5-dimethoxy-2,5-dimethylhexane
CID 552009
5-methoxy-N-(2-methoxyethyl)-2,5-dimethylhexan-1-amine
CID 103036807
ethyl 5-methoxy-2,5-dimethylhexanoate
CID 154290351
(2,6-dimethoxy-6-methylheptan-3-yl)hydrazine
CID 103026551
(6-methoxy-2,2,6-trimethylheptan-3-yl)hydrazine
CID 103026262
dimethyl 2-(3-methoxy-3-methylbutyl)propanedioate
CID 103023222

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3,6-dimethylheptan-1-amine?
The IUPAC name of 6-methoxy-3,6-dimethylheptan-1-amine (CID 103019673) is 6-methoxy-3,6-dimethylheptan-1-amine.
What is the SMILES notation for 6-methoxy-3,6-dimethylheptan-1-amine?
The canonical SMILES for 6-methoxy-3,6-dimethylheptan-1-amine is COC(C)(C)CCC(C)CCN.
What is the InChIKey of 6-methoxy-3,6-dimethylheptan-1-amine?
The InChIKey is JZFRPLKGWQDEPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-9(6-8-11)5-7-10(2,3)12-4/h9H,5-8,11H2,1-4H3.
What are the key properties of 6-methoxy-3,6-dimethylheptan-1-amine?
6-methoxy-3,6-dimethylheptan-1-amine has a molecular weight of 173.30 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3,6-dimethylheptan-1-amine is sourced from PubChem (CID 103019673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).