2-methoxy-7-methyldecan-5-amine

C12H27NO — CID 105138036

IUPAC2-methoxy-7-methyldecan-5-amine
SMILESCCCC(C)CC(N)CCC(C)OC
InChIInChI=1S/C12H27NO/c1-5-6-10(2)9-12(13)8-7-11(3)14-4/h10-12H,5-9,13H2,1-4H3
InChIKeyRNHNVMLGNDZFRB-UHFFFAOYSA-N
MW201.35 g/mol
LogP2.96
Rot. Bonds8

About 2-methoxy-7-methyldecan-5-amine

2-methoxy-7-methyldecan-5-amine (PubChem CID 105138036) has the molecular formula C12H27NO and a molecular weight of 201.35 g/mol. Its IUPAC name is 2-methoxy-7-methyldecan-5-amine.

Molecular Properties

Compound Name2-methoxy-7-methyldecan-5-amine
PubChem CID105138036
Molecular FormulaC12H27NO
Molecular Weight201.35 g/mol
Exact Mass201.21
IUPAC Name2-methoxy-7-methyldecan-5-amine
SMILESCCCC(C)CC(N)CCC(C)OC
InChIInChI=1S/C12H27NO/c1-5-6-10(2)9-12(13)8-7-11(3)14-4/h10-12H,5-9,13H2,1-4H3
InChIKeyRNHNVMLGNDZFRB-UHFFFAOYSA-N
XLogP2.96
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.35
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxyheptadecan-5-amine
CID 105138558
5-methyloctan-3-amine
CID 62599907
2-methoxy-5-methyloctan-3-amine
CID 79616792
2-methoxy-6,10-dimethyltridecane
CID 91615428
(2S)-2-amino-5-methoxyhexan-1-ol
CID 58308158
4-methyl-1-propan-2-ylsulfanylheptan-2-amine
CID 65132167
6-methylnonan-3-amine
CID 62266250
1-methoxy-2-methyloctan-4-amine
CID 105125248
5-methyl-1-phenoxyoctan-3-amine
CID 55095717
(3S,5R)-3-amino-5-methyloctanoic acid;hydrochloride
CID 11701275
4-methoxy-7-methyldecan-5-ol
CID 116711734
1-cyclobutyl-5-methoxyhexan-2-amine
CID 105151744

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-7-methyldecan-5-amine?
The IUPAC name of 2-methoxy-7-methyldecan-5-amine (CID 105138036) is 2-methoxy-7-methyldecan-5-amine.
What is the SMILES notation for 2-methoxy-7-methyldecan-5-amine?
The canonical SMILES for 2-methoxy-7-methyldecan-5-amine is CCCC(C)CC(N)CCC(C)OC.
What is the InChIKey of 2-methoxy-7-methyldecan-5-amine?
The InChIKey is RNHNVMLGNDZFRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO/c1-5-6-10(2)9-12(13)8-7-11(3)14-4/h10-12H,5-9,13H2,1-4H3.
What are the key properties of 2-methoxy-7-methyldecan-5-amine?
2-methoxy-7-methyldecan-5-amine has a molecular weight of 201.35 g/mol, XLogP of 2.96, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-7-methyldecan-5-amine is sourced from PubChem (CID 105138036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).