2-ethyl-N-methylpentan-1-amine;propane

C11H27N — CID 143462607

IUPAC2-ethyl-N-methylpentan-1-amine;propane
SMILESCCC.CCCC(CC)CNC
InChIInChI=1S/C8H19N.C3H8/c1-4-6-8(5-2)7-9-3;1-3-2/h8-9H,4-7H2,1-3H3;3H2,1-2H3
InChIKeyNEJQTVJBRUJMPU-UHFFFAOYSA-N
MW173.34 g/mol
LogP3.45
Rot. Bonds5

About 2-ethyl-N-methylpentan-1-amine;propane

2-ethyl-N-methylpentan-1-amine;propane (PubChem CID 143462607) has the molecular formula C11H27N and a molecular weight of 173.34 g/mol. Its IUPAC name is 2-ethyl-N-methylpentan-1-amine;propane.

Molecular Properties

Compound Name2-ethyl-N-methylpentan-1-amine;propane
PubChem CID143462607
Molecular FormulaC11H27N
Molecular Weight173.34 g/mol
Exact Mass173.21
IUPAC Name2-ethyl-N-methylpentan-1-amine;propane
SMILESCCC.CCCC(CC)CNC
InChIInChI=1S/C8H19N.C3H8/c1-4-6-8(5-2)7-9-3;1-3-2/h8-9H,4-7H2,1-3H3;3H2,1-2H3
InChIKeyNEJQTVJBRUJMPU-UHFFFAOYSA-N
XLogP3.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.34
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-N-methylundecan-1-amine
CID 63522579
ethane;2-ethyl-N-methylbutan-1-amine
CID 143337044
4-ethylheptane;methane
CID 143165373
4-ethoxy-2-ethyl-N-methylbutan-1-amine
CID 62530936
4-(methylaminomethyl)hexanal
CID 170602514
3-ethyl-N-(3-ethylhexyl)hexan-1-amine
CID 19083272
2-(2-ethoxyethyl)-N-methylpentan-1-amine
CID 62530717
N,2-dimethyl-4-propylheptan-1-amine
CID 142144004
N',N',2-triethyl-N-methylpentane-1,5-diamine
CID 142375045
N-methyl-2-(2-propan-2-yloxyethyl)pentan-1-amine
CID 62528925
3-[[2-(ethylamino)hydrazinyl]methyl]hexane
CID 166965028
ethane;2-ethyl-N'-methylpropane-1,3-diamine
CID 144511427

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methylpentan-1-amine;propane?
The IUPAC name of 2-ethyl-N-methylpentan-1-amine;propane (CID 143462607) is 2-ethyl-N-methylpentan-1-amine;propane.
What is the SMILES notation for 2-ethyl-N-methylpentan-1-amine;propane?
The canonical SMILES for 2-ethyl-N-methylpentan-1-amine;propane is CCC.CCCC(CC)CNC.
What is the InChIKey of 2-ethyl-N-methylpentan-1-amine;propane?
The InChIKey is NEJQTVJBRUJMPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N.C3H8/c1-4-6-8(5-2)7-9-3;1-3-2/h8-9H,4-7H2,1-3H3;3H2,1-2H3.
What are the key properties of 2-ethyl-N-methylpentan-1-amine;propane?
2-ethyl-N-methylpentan-1-amine;propane has a molecular weight of 173.34 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methylpentan-1-amine;propane is sourced from PubChem (CID 143462607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).