1-(3-methylheptan-2-yl)imidazolidine

C11H24N2 — CID 174705189

IUPAC1-(3-methylheptan-2-yl)imidazolidine
SMILESCCCCC(C)C(C)N1CCNC1
InChIInChI=1S/C11H24N2/c1-4-5-6-10(2)11(3)13-8-7-12-9-13/h10-12H,4-9H2,1-3H3
InChIKeyGHVTVHYCAKWWBS-UHFFFAOYSA-N
MW184.33 g/mol
LogP2.06
Rot. Bonds5

About 1-(3-methylheptan-2-yl)imidazolidine

1-(3-methylheptan-2-yl)imidazolidine (PubChem CID 174705189) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 1-(3-methylheptan-2-yl)imidazolidine.

Molecular Properties

Compound Name1-(3-methylheptan-2-yl)imidazolidine
PubChem CID174705189
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name1-(3-methylheptan-2-yl)imidazolidine
SMILESCCCCC(C)C(C)N1CCNC1
InChIInChI=1S/C11H24N2/c1-4-5-6-10(2)11(3)13-8-7-12-9-13/h10-12H,4-9H2,1-3H3
InChIKeyGHVTVHYCAKWWBS-UHFFFAOYSA-N
XLogP2.06
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methylheptan-2-yl)imidazolidine?
The IUPAC name of 1-(3-methylheptan-2-yl)imidazolidine (CID 174705189) is 1-(3-methylheptan-2-yl)imidazolidine.
What is the SMILES notation for 1-(3-methylheptan-2-yl)imidazolidine?
The canonical SMILES for 1-(3-methylheptan-2-yl)imidazolidine is CCCCC(C)C(C)N1CCNC1.
What is the InChIKey of 1-(3-methylheptan-2-yl)imidazolidine?
The InChIKey is GHVTVHYCAKWWBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-4-5-6-10(2)11(3)13-8-7-12-9-13/h10-12H,4-9H2,1-3H3.
What are the key properties of 1-(3-methylheptan-2-yl)imidazolidine?
1-(3-methylheptan-2-yl)imidazolidine has a molecular weight of 184.33 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylheptan-2-yl)imidazolidine is sourced from PubChem (CID 174705189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).