2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine

C17H34N2 — CID 71175976

IUPAC2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine
SMILESCC(C)=CCCC(C)C1N(C(C)C)CCN1C(C)C
InChIInChI=1S/C17H34N2/c1-13(2)9-8-10-16(7)17-18(14(3)4)11-12-19(17)15(5)6/h9,14-17H,8,10-12H2,1-7H3
InChIKeySBJAFAUAXDIOMZ-UHFFFAOYSA-N
MW266.47 g/mol
LogP4.13
Rot. Bonds6

About 2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine

2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine (PubChem CID 71175976) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine.

Molecular Properties

Compound Name2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine
PubChem CID71175976
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine
SMILESCC(C)=CCCC(C)C1N(C(C)C)CCN1C(C)C
InChIInChI=1S/C17H34N2/c1-13(2)9-8-10-16(7)17-18(14(3)4)11-12-19(17)15(5)6/h9,14-17H,8,10-12H2,1-7H3
InChIKeySBJAFAUAXDIOMZ-UHFFFAOYSA-N
XLogP4.13
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine?
The IUPAC name of 2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine (CID 71175976) is 2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine.
What is the SMILES notation for 2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine?
The canonical SMILES for 2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine is CC(C)=CCCC(C)C1N(C(C)C)CCN1C(C)C.
What is the InChIKey of 2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine?
The InChIKey is SBJAFAUAXDIOMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-13(2)9-8-10-16(7)17-18(14(3)4)11-12-19(17)15(5)6/h9,14-17H,8,10-12H2,1-7H3.
What are the key properties of 2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine?
2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine has a molecular weight of 266.47 g/mol, XLogP of 4.13, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methylhept-5-en-2-yl)-1,3-di(propan-2-yl)imidazolidine is sourced from PubChem (CID 71175976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).