N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine

C11H21N — CID 58175095

IUPACN,N,3,4,5-pentamethylhexa-2,4-dien-2-amine
SMILESCC(C)=C(C)C(C)=C(C)N(C)C
InChIInChI=1S/C11H21N/c1-8(2)9(3)10(4)11(5)12(6)7/h1-7H3
InChIKeyPQJFKSUJCSBHMF-UHFFFAOYSA-N
MW167.30 g/mol
LogP3.20
Rot. Bonds2

About N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine

N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine (PubChem CID 58175095) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine.

Molecular Properties

Compound NameN,N,3,4,5-pentamethylhexa-2,4-dien-2-amine
PubChem CID58175095
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN,N,3,4,5-pentamethylhexa-2,4-dien-2-amine
SMILESCC(C)=C(C)C(C)=C(C)N(C)C
InChIInChI=1S/C11H21N/c1-8(2)9(3)10(4)11(5)12(6)7/h1-7H3
InChIKeyPQJFKSUJCSBHMF-UHFFFAOYSA-N
XLogP3.20
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N,2,4-tetramethylpent-2-en-3-amine
CID 15569626
Hexamethyl propylene amine
CID 129662513
Pentamethyl propyleneamine
CID 129720895
(2E)-3-fluoro-N,N,4-trimethylpenta-2,4-dien-2-amine
CID 139386354
(E)-N-(fluoromethyl)-N,3-dimethylpent-2-en-2-amine
CID 174345955
(E)-N,N,3,4-tetramethylpent-2-en-2-amine
CID 22950141
N,N,2-trimethylpent-2-en-3-amine
CID 57161466
N,N,3-trimethylpent-2-en-2-amine
CID 57553790
1,2,4,5-tetramethyl-3H-pyrrol-3-ide;yttrium
CID 58130802
dimethylazanide;1-ethyl-2,4,5-trimethyl-3H-pyrrol-3-ide;tungsten(2+)
CID 58280496
1,2,3,4,5,6-Hexamethylpyridazine
CID 58302942
dimethylazanide;1-ethyl-2,4,5-trimethyl-3H-pyrrol-3-ide;yttrium
CID 59826895

Frequently Asked Questions

What is the IUPAC name of N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine?
The IUPAC name of N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine (CID 58175095) is N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine.
What is the SMILES notation for N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine?
The canonical SMILES for N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine is CC(C)=C(C)C(C)=C(C)N(C)C.
What is the InChIKey of N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine?
The InChIKey is PQJFKSUJCSBHMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-8(2)9(3)10(4)11(5)12(6)7/h1-7H3.
What are the key properties of N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine?
N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine has a molecular weight of 167.30 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3,4,5-pentamethylhexa-2,4-dien-2-amine is sourced from PubChem (CID 58175095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).