(Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine

C10H21N — CID 59586849

IUPAC(Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine
SMILESCCN(/C=C\C(C)C)C(C)C
InChIInChI=1S/C10H21N/c1-6-11(10(4)5)8-7-9(2)3/h7-10H,6H2,1-5H3/b8-7-
InChIKeyQVQLKISZFVQDHJ-FPLPWBNLSA-N
MW155.28 g/mol
LogP2.89
Rot. Bonds4

About (Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine

(Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine (PubChem CID 59586849) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is (Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine
PubChem CID59586849
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name(Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine
SMILESCCN(/C=C\C(C)C)C(C)C
InChIInChI=1S/C10H21N/c1-6-11(10(4)5)8-7-9(2)3/h7-10H,6H2,1-5H3/b8-7-
InChIKeyQVQLKISZFVQDHJ-FPLPWBNLSA-N
XLogP2.89
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine?
The IUPAC name of (Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine (CID 59586849) is (Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine.
What is the SMILES notation for (Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine?
The canonical SMILES for (Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine is CCN(/C=C\C(C)C)C(C)C.
What is the InChIKey of (Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine?
The InChIKey is QVQLKISZFVQDHJ-FPLPWBNLSA-N. The full InChI is InChI=1S/C10H21N/c1-6-11(10(4)5)8-7-9(2)3/h7-10H,6H2,1-5H3/b8-7-.
What are the key properties of (Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine?
(Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.89, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-3-methyl-N-propan-2-ylbut-1-en-1-amine is sourced from PubChem (CID 59586849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).