2-methoxy-5-methyloctan-3-amine

C10H23NO — CID 79616792

IUPAC2-methoxy-5-methyloctan-3-amine
SMILESCCCC(C)CC(N)C(C)OC
InChIInChI=1S/C10H23NO/c1-5-6-8(2)7-10(11)9(3)12-4/h8-10H,5-7,11H2,1-4H3
InChIKeyYKTXWBMQTIJFSD-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.17
Rot. Bonds6

About 2-methoxy-5-methyloctan-3-amine

2-methoxy-5-methyloctan-3-amine (PubChem CID 79616792) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 2-methoxy-5-methyloctan-3-amine.

Molecular Properties

Compound Name2-methoxy-5-methyloctan-3-amine
PubChem CID79616792
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name2-methoxy-5-methyloctan-3-amine
SMILESCCCC(C)CC(N)C(C)OC
InChIInChI=1S/C10H23NO/c1-5-6-8(2)7-10(11)9(3)12-4/h8-10H,5-7,11H2,1-4H3
InChIKeyYKTXWBMQTIJFSD-UHFFFAOYSA-N
XLogP2.17
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 ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-6-methylnonan-4-amine
CID 115845628
2-methoxy-7-methyldecan-5-amine
CID 105138036
5-methyloctan-3-amine
CID 62599907
2-methoxycarbonyl-4-methylheptanoic acid
CID 103973369
4-methoxy-7-methyldecan-5-ol
CID 116711734
2-(3-chlorophenoxy)-5-methyloctan-3-amine
CID 105137963
(4R)-3-methoxy-2-methylheptan-4-amine
CID 104932507
4-methyl-1,1-diphenylheptan-2-amine
CID 63412141
4-methylheptane
CID 91413347
4-methylheptane
CID 11512
2-methoxy-5-methylideneheptan-3-amine
CID 79616919
4,5,7-trimethyldecane
CID 57490926

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-methyloctan-3-amine?
The IUPAC name of 2-methoxy-5-methyloctan-3-amine (CID 79616792) is 2-methoxy-5-methyloctan-3-amine.
What is the SMILES notation for 2-methoxy-5-methyloctan-3-amine?
The canonical SMILES for 2-methoxy-5-methyloctan-3-amine is CCCC(C)CC(N)C(C)OC.
What is the InChIKey of 2-methoxy-5-methyloctan-3-amine?
The InChIKey is YKTXWBMQTIJFSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-5-6-8(2)7-10(11)9(3)12-4/h8-10H,5-7,11H2,1-4H3.
What are the key properties of 2-methoxy-5-methyloctan-3-amine?
2-methoxy-5-methyloctan-3-amine has a molecular weight of 173.30 g/mol, XLogP of 2.17, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-methyloctan-3-amine is sourced from PubChem (CID 79616792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).