(Z)-N,N,2-trimethylbut-1-en-1-amine

C7H15N — CID 12816149

IUPAC(Z)-N,N,2-trimethylbut-1-en-1-amine
SMILESCC/C(C)=C\N(C)C
InChIInChI=1S/C7H15N/c1-5-7(2)6-8(3)4/h6H,5H2,1-4H3/b7-6-
InChIKeyBOQQQSDUGYWFLU-SREVYHEPSA-N
MW113.20 g/mol
LogP1.86
Rot. Bonds2

About (Z)-N,N,2-trimethylbut-1-en-1-amine

(Z)-N,N,2-trimethylbut-1-en-1-amine (PubChem CID 12816149) has the molecular formula C7H15N and a molecular weight of 113.20 g/mol. Its IUPAC name is (Z)-N,N,2-trimethylbut-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N,N,2-trimethylbut-1-en-1-amine
PubChem CID12816149
Molecular FormulaC7H15N
Molecular Weight113.20 g/mol
Exact Mass113.12
IUPAC Name(Z)-N,N,2-trimethylbut-1-en-1-amine
SMILESCC/C(C)=C\N(C)C
InChIInChI=1S/C7H15N/c1-5-7(2)6-8(3)4/h6H,5H2,1-4H3/b7-6-
InChIKeyBOQQQSDUGYWFLU-SREVYHEPSA-N
XLogP1.86
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.20
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (Z)-N,N,2-trimethylbut-1-en-1-amine?
The IUPAC name of (Z)-N,N,2-trimethylbut-1-en-1-amine (CID 12816149) is (Z)-N,N,2-trimethylbut-1-en-1-amine.
What is the SMILES notation for (Z)-N,N,2-trimethylbut-1-en-1-amine?
The canonical SMILES for (Z)-N,N,2-trimethylbut-1-en-1-amine is CC/C(C)=C\N(C)C.
What is the InChIKey of (Z)-N,N,2-trimethylbut-1-en-1-amine?
The InChIKey is BOQQQSDUGYWFLU-SREVYHEPSA-N. The full InChI is InChI=1S/C7H15N/c1-5-7(2)6-8(3)4/h6H,5H2,1-4H3/b7-6-.
What are the key properties of (Z)-N,N,2-trimethylbut-1-en-1-amine?
(Z)-N,N,2-trimethylbut-1-en-1-amine has a molecular weight of 113.20 g/mol, XLogP of 1.86, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,N,2-trimethylbut-1-en-1-amine is sourced from PubChem (CID 12816149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).