1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one

C10H15F3N2O — CID 139389092

IUPAC1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one
SMILESO=C1NCCN1CCCC1(C(F)(F)F)CC1
InChIInChI=1S/C10H15F3N2O/c11-10(12,13)9(3-4-9)2-1-6-15-7-5-14-8(15)16/h1-7H2,(H,14,16)
InChIKeyFTHDWFKUZWPNPE-UHFFFAOYSA-N
MW236.24 g/mol
LogP2.13
Rot. Bonds4

About 1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one

1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one (PubChem CID 139389092) has the molecular formula C10H15F3N2O and a molecular weight of 236.24 g/mol. Its IUPAC name is 1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one
PubChem CID139389092
Molecular FormulaC10H15F3N2O
Molecular Weight236.24 g/mol
Exact Mass236.11
IUPAC Name1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one
SMILESO=C1NCCN1CCCC1(C(F)(F)F)CC1
InChIInChI=1S/C10H15F3N2O/c11-10(12,13)9(3-4-9)2-1-6-15-7-5-14-8(15)16/h1-7H2,(H,14,16)
InChIKeyFTHDWFKUZWPNPE-UHFFFAOYSA-N
XLogP2.13
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.24
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one?
The IUPAC name of 1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one (CID 139389092) is 1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one.
What is the SMILES notation for 1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one?
The canonical SMILES for 1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one is O=C1NCCN1CCCC1(C(F)(F)F)CC1.
What is the InChIKey of 1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one?
The InChIKey is FTHDWFKUZWPNPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N2O/c11-10(12,13)9(3-4-9)2-1-6-15-7-5-14-8(15)16/h1-7H2,(H,14,16).
What are the key properties of 1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one?
1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one has a molecular weight of 236.24 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[1-(trifluoromethyl)cyclopropyl]propyl]imidazolidin-2-one is sourced from PubChem (CID 139389092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).