1,3-dipropyl-1,3-diazinane

C10H22N2 — CID 3405835

IUPAC1,3-dipropyl-1,3-diazinane
SMILESCCCN1CCCN(CCC)C1
InChIInChI=1S/C10H22N2/c1-3-6-11-8-5-9-12(10-11)7-4-2/h3-10H2,1-2H3
InChIKeyKLRFSBNLIJGSDP-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.77
Rot. Bonds4

About 1,3-dipropyl-1,3-diazinane

1,3-dipropyl-1,3-diazinane (PubChem CID 3405835) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 1,3-dipropyl-1,3-diazinane.

Molecular Properties

Compound Name1,3-dipropyl-1,3-diazinane
PubChem CID3405835
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name1,3-dipropyl-1,3-diazinane
SMILESCCCN1CCCN(CCC)C1
InChIInChI=1S/C10H22N2/c1-3-6-11-8-5-9-12(10-11)7-4-2/h3-10H2,1-2H3
InChIKeyKLRFSBNLIJGSDP-UHFFFAOYSA-N
XLogP1.77
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,3-dipropyl-1,3-diazinane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,3-dipropyl-1,3-diazinane?
The IUPAC name of 1,3-dipropyl-1,3-diazinane (CID 3405835) is 1,3-dipropyl-1,3-diazinane.
What is the SMILES notation for 1,3-dipropyl-1,3-diazinane?
The canonical SMILES for 1,3-dipropyl-1,3-diazinane is CCCN1CCCN(CCC)C1.
What is the InChIKey of 1,3-dipropyl-1,3-diazinane?
The InChIKey is KLRFSBNLIJGSDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-3-6-11-8-5-9-12(10-11)7-4-2/h3-10H2,1-2H3.
What are the key properties of 1,3-dipropyl-1,3-diazinane?
1,3-dipropyl-1,3-diazinane has a molecular weight of 170.30 g/mol, XLogP of 1.77, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dipropyl-1,3-diazinane is sourced from PubChem (CID 3405835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).