1,3-dimethyl-4-pentan-3-ylimidazolidine

C10H22N2 — CID 138630846

IUPAC1,3-dimethyl-4-pentan-3-ylimidazolidine
SMILESCCC(CC)C1CN(C)CN1C
InChIInChI=1S/C10H22N2/c1-5-9(6-2)10-7-11(3)8-12(10)4/h9-10H,5-8H2,1-4H3
InChIKeyFWOITEITXBUBNI-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.63
Rot. Bonds3

About 1,3-dimethyl-4-pentan-3-ylimidazolidine

1,3-dimethyl-4-pentan-3-ylimidazolidine (PubChem CID 138630846) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 1,3-dimethyl-4-pentan-3-ylimidazolidine.

Molecular Properties

Compound Name1,3-dimethyl-4-pentan-3-ylimidazolidine
PubChem CID138630846
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name1,3-dimethyl-4-pentan-3-ylimidazolidine
SMILESCCC(CC)C1CN(C)CN1C
InChIInChI=1S/C10H22N2/c1-5-9(6-2)10-7-11(3)8-12(10)4/h9-10H,5-8H2,1-4H3
InChIKeyFWOITEITXBUBNI-UHFFFAOYSA-N
XLogP1.63
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-4-pentan-3-ylimidazolidine?
The IUPAC name of 1,3-dimethyl-4-pentan-3-ylimidazolidine (CID 138630846) is 1,3-dimethyl-4-pentan-3-ylimidazolidine.
What is the SMILES notation for 1,3-dimethyl-4-pentan-3-ylimidazolidine?
The canonical SMILES for 1,3-dimethyl-4-pentan-3-ylimidazolidine is CCC(CC)C1CN(C)CN1C.
What is the InChIKey of 1,3-dimethyl-4-pentan-3-ylimidazolidine?
The InChIKey is FWOITEITXBUBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-5-9(6-2)10-7-11(3)8-12(10)4/h9-10H,5-8H2,1-4H3.
What are the key properties of 1,3-dimethyl-4-pentan-3-ylimidazolidine?
1,3-dimethyl-4-pentan-3-ylimidazolidine has a molecular weight of 170.30 g/mol, XLogP of 1.63, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4-pentan-3-ylimidazolidine is sourced from PubChem (CID 138630846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).