2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine

C11H21N — CID 153496766

IUPAC2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine
SMILESC=CCC(CC)(CC=C)CNC
InChIInChI=1S/C11H21N/c1-5-8-11(7-3,9-6-2)10-12-4/h5-6,12H,1-2,7-10H2,3-4H3
InChIKeySLLPQGKDDOVGTP-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.75
Rot. Bonds7

About 2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine

2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine (PubChem CID 153496766) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine.

Molecular Properties

Compound Name2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine
PubChem CID153496766
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine
SMILESC=CCC(CC)(CC=C)CNC
InChIInChI=1S/C11H21N/c1-5-8-11(7-3,9-6-2)10-12-4/h5-6,12H,1-2,7-10H2,3-4H3
InChIKeySLLPQGKDDOVGTP-UHFFFAOYSA-N
XLogP2.75
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-ethyl-N,N'-dimethyl-2-(methylaminomethyl)propane-1,3-diamine
CID 59289836
3-ethyl-3-prop-2-enylhex-5-en-1-amine
CID 153496771
N,2-dimethyl-2-prop-2-enylpent-4-en-1-amine
CID 153496767
N-(2,2-diethylpent-4-enyl)-N-ethylhydroxylamine
CID 155131371
2,2,4-triethyl-N-methylhexan-1-amine
CID 82930849
2-(2,2-diethylpent-4-enyl)oxirane
CID 135036656
2-methyl-N-(2-methylbutan-2-yl)pent-4-en-2-amine
CID 142811014
N,2,2-trimethylbut-3-en-1-amine
CID 55288138
2,2-diethyl-5-methoxy-N,5-dimethylhexan-1-amine
CID 103036795
(3R)-3-ethyl-2-methylhex-5-en-3-ol
CID 59911066
N,2,2-triethyl-N'-methyl-N-propylpropane-1,3-diamine
CID 62262351
2-ethyl-N-methyl-2-(2-methylsulfonylethyl)hexan-1-amine
CID 62723627

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine?
The IUPAC name of 2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine (CID 153496766) is 2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine.
What is the SMILES notation for 2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine?
The canonical SMILES for 2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine is C=CCC(CC)(CC=C)CNC.
What is the InChIKey of 2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine?
The InChIKey is SLLPQGKDDOVGTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-5-8-11(7-3,9-6-2)10-12-4/h5-6,12H,1-2,7-10H2,3-4H3.
What are the key properties of 2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine?
2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine has a molecular weight of 167.30 g/mol, XLogP of 2.75, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methyl-2-prop-2-enylpent-4-en-1-amine is sourced from PubChem (CID 153496766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).