3-propan-2-yldiazinane

C7H16N2 — CID 153427717

IUPAC3-propan-2-yldiazinane
SMILESCC(C)C1CCCNN1
InChIInChI=1S/C7H16N2/c1-6(2)7-4-3-5-8-9-7/h6-9H,3-5H2,1-2H3
InChIKeyZTHGRYGZDFLNRG-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.90
Rot. Bonds1

About 3-propan-2-yldiazinane

3-propan-2-yldiazinane (PubChem CID 153427717) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is 3-propan-2-yldiazinane.

Molecular Properties

Compound Name3-propan-2-yldiazinane
PubChem CID153427717
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name3-propan-2-yldiazinane
SMILESCC(C)C1CCCNN1
InChIInChI=1S/C7H16N2/c1-6(2)7-4-3-5-8-9-7/h6-9H,3-5H2,1-2H3
InChIKeyZTHGRYGZDFLNRG-UHFFFAOYSA-N
XLogP0.90
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-propan-2-ylpiperidine
CID 7022854
(2S,6S)-2,6-di(propan-2-yl)piperidine;methane
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ethane;2-propan-2-ylpiperidine
CID 154671868
(2R)-2-propan-2-ylazepane
CID 7048221
(2S)-2-[(2R,3S)-3-[(2S)-pyrrolidin-2-yl]butan-2-yl]pyrrolidine
CID 129418670
2-(1-piperidin-2-ylethyl)piperidine
CID 19900914
methane;2-propan-2-ylazetidine;propan-2-ylcyclobutane
CID 159611359
2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane
CID 170772133
(2S)-2-[(2S)-butan-2-yl]pyrrolidine
CID 7047855
N,N,2-trimethyl-1-pyrrolidin-2-ylpropan-1-amine
CID 116906314
4-propan-2-yl-1,3-diazinane
CID 58473806
N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine
CID 116950860

Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yldiazinane?
The IUPAC name of 3-propan-2-yldiazinane (CID 153427717) is 3-propan-2-yldiazinane.
What is the SMILES notation for 3-propan-2-yldiazinane?
The canonical SMILES for 3-propan-2-yldiazinane is CC(C)C1CCCNN1.
What is the InChIKey of 3-propan-2-yldiazinane?
The InChIKey is ZTHGRYGZDFLNRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-6(2)7-4-3-5-8-9-7/h6-9H,3-5H2,1-2H3.
What are the key properties of 3-propan-2-yldiazinane?
3-propan-2-yldiazinane has a molecular weight of 128.22 g/mol, XLogP of 0.90, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yldiazinane is sourced from PubChem (CID 153427717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).