(E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine

C12H25N — CID 126552469

IUPAC(E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine
SMILESC/C(=C(/C)C(C)(C)C)N(C)C(C)C
InChIInChI=1S/C12H25N/c1-9(2)13(8)11(4)10(3)12(5,6)7/h9H,1-8H3/b11-10+
InChIKeyYEZGSOZBXYGHCZ-ZHACJKMWSA-N
MW183.34 g/mol
LogP3.67
Rot. Bonds2

About (E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine

(E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine (PubChem CID 126552469) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is (E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine.

Molecular Properties

Compound Name(E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine
PubChem CID126552469
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name(E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine
SMILESC/C(=C(/C)C(C)(C)C)N(C)C(C)C
InChIInChI=1S/C12H25N/c1-9(2)13(8)11(4)10(3)12(5,6)7/h9H,1-8H3/b11-10+
InChIKeyYEZGSOZBXYGHCZ-ZHACJKMWSA-N
XLogP3.67
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine?
The IUPAC name of (E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine (CID 126552469) is (E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine.
What is the SMILES notation for (E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine?
The canonical SMILES for (E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine is C/C(=C(/C)C(C)(C)C)N(C)C(C)C.
What is the InChIKey of (E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine?
The InChIKey is YEZGSOZBXYGHCZ-ZHACJKMWSA-N. The full InChI is InChI=1S/C12H25N/c1-9(2)13(8)11(4)10(3)12(5,6)7/h9H,1-8H3/b11-10+.
What are the key properties of (E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine?
(E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine has a molecular weight of 183.34 g/mol, XLogP of 3.67, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,3,4,4-tetramethyl-N-propan-2-ylpent-2-en-2-amine is sourced from PubChem (CID 126552469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).