1,3-di(propan-2-yl)-1,3-diazinane

C10H22N2 — CID 12634509

IUPAC1,3-di(propan-2-yl)-1,3-diazinane
SMILESCC(C)N1CCCN(C(C)C)C1
InChIInChI=1S/C10H22N2/c1-9(2)11-6-5-7-12(8-11)10(3)4/h9-10H,5-8H2,1-4H3
InChIKeyRQVDQEZQFYQRTH-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.77
Rot. Bonds2

About 1,3-di(propan-2-yl)-1,3-diazinane

1,3-di(propan-2-yl)-1,3-diazinane (PubChem CID 12634509) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 1,3-di(propan-2-yl)-1,3-diazinane.

Molecular Properties

Compound Name1,3-di(propan-2-yl)-1,3-diazinane
PubChem CID12634509
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name1,3-di(propan-2-yl)-1,3-diazinane
SMILESCC(C)N1CCCN(C(C)C)C1
InChIInChI=1S/C10H22N2/c1-9(2)11-6-5-7-12(8-11)10(3)4/h9-10H,5-8H2,1-4H3
InChIKeyRQVDQEZQFYQRTH-UHFFFAOYSA-N
XLogP1.77
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
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

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Frequently Asked Questions

What is the IUPAC name of 1,3-di(propan-2-yl)-1,3-diazinane?
The IUPAC name of 1,3-di(propan-2-yl)-1,3-diazinane (CID 12634509) is 1,3-di(propan-2-yl)-1,3-diazinane.
What is the SMILES notation for 1,3-di(propan-2-yl)-1,3-diazinane?
The canonical SMILES for 1,3-di(propan-2-yl)-1,3-diazinane is CC(C)N1CCCN(C(C)C)C1.
What is the InChIKey of 1,3-di(propan-2-yl)-1,3-diazinane?
The InChIKey is RQVDQEZQFYQRTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-9(2)11-6-5-7-12(8-11)10(3)4/h9-10H,5-8H2,1-4H3.
What are the key properties of 1,3-di(propan-2-yl)-1,3-diazinane?
1,3-di(propan-2-yl)-1,3-diazinane has a molecular weight of 170.30 g/mol, XLogP of 1.77, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-di(propan-2-yl)-1,3-diazinane is sourced from PubChem (CID 12634509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).