6-ethyl-2-methyloctan-1-amine

C11H25N — CID 169188535

IUPAC6-ethyl-2-methyloctan-1-amine
SMILESCCC(CC)CCCC(C)CN
InChIInChI=1S/C11H25N/c1-4-11(5-2)8-6-7-10(3)9-12/h10-11H,4-9,12H2,1-3H3
InChIKeyYGFPISPAUPVAGV-UHFFFAOYSA-N
MW171.33 g/mol
LogP3.19
Rot. Bonds7

About 6-ethyl-2-methyloctan-1-amine

6-ethyl-2-methyloctan-1-amine (PubChem CID 169188535) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is 6-ethyl-2-methyloctan-1-amine.

Molecular Properties

Compound Name6-ethyl-2-methyloctan-1-amine
PubChem CID169188535
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC Name6-ethyl-2-methyloctan-1-amine
SMILESCCC(CC)CCCC(C)CN
InChIInChI=1S/C11H25N/c1-4-11(5-2)8-6-7-10(3)9-12/h10-11H,4-9,12H2,1-3H3
InChIKeyYGFPISPAUPVAGV-UHFFFAOYSA-N
XLogP3.19
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethyl-7-methylnonane
CID 526426
(7R,11R,15R,19R,23R,27S)-3-ethyl-7,11,15,19,23,27-hexamethylnonacosane
CID 90874427
3,7-diethylnonane
CID 22089120
(2S)-2,6-dimethylheptan-1-amine
CID 13329794
3-ethyl-8-methyldecane
CID 57490930
4-ethyl-2-methylheptane-1,7-diamine
CID 18353547
3-ethyl-10-methyldodecane
CID 54169175
N'-(2-ethylhexyl)-2-methylpentane-1,5-diamine
CID 107815978
2-methyltricosan-1-amine
CID 87547792
2-methylnonan-1-amine
CID 21396878
2-methyloctadecan-1-amine
CID 56980469
4-ethyl-2-methyloctadecan-1-amine
CID 139984402

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-methyloctan-1-amine?
The IUPAC name of 6-ethyl-2-methyloctan-1-amine (CID 169188535) is 6-ethyl-2-methyloctan-1-amine.
What is the SMILES notation for 6-ethyl-2-methyloctan-1-amine?
The canonical SMILES for 6-ethyl-2-methyloctan-1-amine is CCC(CC)CCCC(C)CN.
What is the InChIKey of 6-ethyl-2-methyloctan-1-amine?
The InChIKey is YGFPISPAUPVAGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N/c1-4-11(5-2)8-6-7-10(3)9-12/h10-11H,4-9,12H2,1-3H3.
What are the key properties of 6-ethyl-2-methyloctan-1-amine?
6-ethyl-2-methyloctan-1-amine has a molecular weight of 171.33 g/mol, XLogP of 3.19, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methyloctan-1-amine is sourced from PubChem (CID 169188535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).