4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine

C20H32N2 — CID 59346693

IUPAC4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine
SMILESCC(C)=C1N(C(C)C)CN(CCCc2ccccc2)C1(C)C
InChIInChI=1S/C20H32N2/c1-16(2)19-20(5,6)21(15-22(19)17(3)4)14-10-13-18-11-8-7-9-12-18/h7-9,11-12,17H,10,13-15H2,1-6H3
InChIKeyJGYFDMYBRYHZLL-UHFFFAOYSA-N
MW300.49 g/mol
LogP4.68
Rot. Bonds5

About 4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine

4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine (PubChem CID 59346693) has the molecular formula C20H32N2 and a molecular weight of 300.49 g/mol. Its IUPAC name is 4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine.

Molecular Properties

Compound Name4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine
PubChem CID59346693
Molecular FormulaC20H32N2
Molecular Weight300.49 g/mol
Exact Mass300.26
IUPAC Name4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine
SMILESCC(C)=C1N(C(C)C)CN(CCCc2ccccc2)C1(C)C
InChIInChI=1S/C20H32N2/c1-16(2)19-20(5,6)21(15-22(19)17(3)4)14-10-13-18-11-8-7-9-12-18/h7-9,11-12,17H,10,13-15H2,1-6H3
InChIKeyJGYFDMYBRYHZLL-UHFFFAOYSA-N
XLogP4.68
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.49
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine?
The IUPAC name of 4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine (CID 59346693) is 4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine.
What is the SMILES notation for 4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine?
The canonical SMILES for 4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine is CC(C)=C1N(C(C)C)CN(CCCc2ccccc2)C1(C)C.
What is the InChIKey of 4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine?
The InChIKey is JGYFDMYBRYHZLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2/c1-16(2)19-20(5,6)21(15-22(19)17(3)4)14-10-13-18-11-8-7-9-12-18/h7-9,11-12,17H,10,13-15H2,1-6H3.
What are the key properties of 4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine?
4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine has a molecular weight of 300.49 g/mol, XLogP of 4.68, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-3-(3-phenylpropyl)-1-propan-2-yl-5-propan-2-ylideneimidazolidine is sourced from PubChem (CID 59346693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).