(Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine

C11H23N — CID 58200080

IUPAC(Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine
SMILESCC(C)(C)/C=C\NCC(C)(C)C
InChIInChI=1S/C11H23N/c1-10(2,3)7-8-12-9-11(4,5)6/h7-8,12H,9H2,1-6H3/b8-7-
InChIKeyNAPIXEWNJVZRNA-FPLPWBNLSA-N
MW169.31 g/mol
LogP3.18
Rot. Bonds2

About (Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine

(Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine (PubChem CID 58200080) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is (Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine
PubChem CID58200080
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name(Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine
SMILESCC(C)(C)/C=C\NCC(C)(C)C
InChIInChI=1S/C11H23N/c1-10(2,3)7-8-12-9-11(4,5)6/h7-8,12H,9H2,1-6H3/b8-7-
InChIKeyNAPIXEWNJVZRNA-FPLPWBNLSA-N
XLogP3.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine?
The IUPAC name of (Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine (CID 58200080) is (Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine.
What is the SMILES notation for (Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine?
The canonical SMILES for (Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine is CC(C)(C)/C=C\NCC(C)(C)C.
What is the InChIKey of (Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine?
The InChIKey is NAPIXEWNJVZRNA-FPLPWBNLSA-N. The full InChI is InChI=1S/C11H23N/c1-10(2,3)7-8-12-9-11(4,5)6/h7-8,12H,9H2,1-6H3/b8-7-.
What are the key properties of (Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine?
(Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine has a molecular weight of 169.31 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(2,2-dimethylpropyl)-3,3-dimethylbut-1-en-1-amine is sourced from PubChem (CID 58200080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).