4,5,6,7-tetramethyl-1,3-dipropyldiazepine

C15H26N2 — CID 151900831

IUPAC4,5,6,7-tetramethyl-1,3-dipropyldiazepine
SMILESCCCC1=NN(CCC)C(C)=C(C)C(C)=C1C
InChIInChI=1S/C15H26N2/c1-7-9-15-13(5)11(3)12(4)14(6)17(16-15)10-8-2/h7-10H2,1-6H3
InChIKeySSSPRLZPQHOMQW-UHFFFAOYSA-N
MW234.39 g/mol
LogP4.50
Rot. Bonds4

About 4,5,6,7-tetramethyl-1,3-dipropyldiazepine

4,5,6,7-tetramethyl-1,3-dipropyldiazepine (PubChem CID 151900831) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 4,5,6,7-tetramethyl-1,3-dipropyldiazepine.

Molecular Properties

Compound Name4,5,6,7-tetramethyl-1,3-dipropyldiazepine
PubChem CID151900831
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name4,5,6,7-tetramethyl-1,3-dipropyldiazepine
SMILESCCCC1=NN(CCC)C(C)=C(C)C(C)=C1C
InChIInChI=1S/C15H26N2/c1-7-9-15-13(5)11(3)12(4)14(6)17(16-15)10-8-2/h7-10H2,1-6H3
InChIKeySSSPRLZPQHOMQW-UHFFFAOYSA-N
XLogP4.50
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetramethyl-1,3-dipropyldiazepine?
The IUPAC name of 4,5,6,7-tetramethyl-1,3-dipropyldiazepine (CID 151900831) is 4,5,6,7-tetramethyl-1,3-dipropyldiazepine.
What is the SMILES notation for 4,5,6,7-tetramethyl-1,3-dipropyldiazepine?
The canonical SMILES for 4,5,6,7-tetramethyl-1,3-dipropyldiazepine is CCCC1=NN(CCC)C(C)=C(C)C(C)=C1C.
What is the InChIKey of 4,5,6,7-tetramethyl-1,3-dipropyldiazepine?
The InChIKey is SSSPRLZPQHOMQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-7-9-15-13(5)11(3)12(4)14(6)17(16-15)10-8-2/h7-10H2,1-6H3.
What are the key properties of 4,5,6,7-tetramethyl-1,3-dipropyldiazepine?
4,5,6,7-tetramethyl-1,3-dipropyldiazepine has a molecular weight of 234.39 g/mol, XLogP of 4.50, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetramethyl-1,3-dipropyldiazepine is sourced from PubChem (CID 151900831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).