N-ethenyl-N,3,3-trimethylbutan-1-amine

C9H19N — CID 129310379

IUPACN-ethenyl-N,3,3-trimethylbutan-1-amine
SMILESC=CN(C)CCC(C)(C)C
InChIInChI=1S/C9H19N/c1-6-10(5)8-7-9(2,3)4/h6H,1,7-8H2,2-5H3
InChIKeyNHNJVJNZZQAIMH-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.50
Rot. Bonds3

About N-ethenyl-N,3,3-trimethylbutan-1-amine

N-ethenyl-N,3,3-trimethylbutan-1-amine (PubChem CID 129310379) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is N-ethenyl-N,3,3-trimethylbutan-1-amine.

Molecular Properties

Compound NameN-ethenyl-N,3,3-trimethylbutan-1-amine
PubChem CID129310379
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC NameN-ethenyl-N,3,3-trimethylbutan-1-amine
SMILESC=CN(C)CCC(C)(C)C
InChIInChI=1S/C9H19N/c1-6-10(5)8-7-9(2,3)4/h6H,1,7-8H2,2-5H3
InChIKeyNHNJVJNZZQAIMH-UHFFFAOYSA-N
XLogP2.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N,3,3-trimethylbutan-1-amine?
The IUPAC name of N-ethenyl-N,3,3-trimethylbutan-1-amine (CID 129310379) is N-ethenyl-N,3,3-trimethylbutan-1-amine.
What is the SMILES notation for N-ethenyl-N,3,3-trimethylbutan-1-amine?
The canonical SMILES for N-ethenyl-N,3,3-trimethylbutan-1-amine is C=CN(C)CCC(C)(C)C.
What is the InChIKey of N-ethenyl-N,3,3-trimethylbutan-1-amine?
The InChIKey is NHNJVJNZZQAIMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-6-10(5)8-7-9(2,3)4/h6H,1,7-8H2,2-5H3.
What are the key properties of N-ethenyl-N,3,3-trimethylbutan-1-amine?
N-ethenyl-N,3,3-trimethylbutan-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N,3,3-trimethylbutan-1-amine is sourced from PubChem (CID 129310379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).