3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one

C14H26N2O — CID 83243576

IUPAC3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)C)N(CC2CCC2)C1=O
InChIInChI=1S/C14H26N2O/c1-4-6-12-14(17)16(9-11-7-5-8-11)13(15-12)10(2)3/h10-13,15H,4-9H2,1-3H3
InChIKeyPOKMVPWNESDVPS-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.37
Rot. Bonds5

About 3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one

3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one (PubChem CID 83243576) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
PubChem CID83243576
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)C)N(CC2CCC2)C1=O
InChIInChI=1S/C14H26N2O/c1-4-6-12-14(17)16(9-11-7-5-8-11)13(15-12)10(2)3/h10-13,15H,4-9H2,1-3H3
InChIKeyPOKMVPWNESDVPS-UHFFFAOYSA-N
XLogP2.37
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butyl-3-(cyclobutylmethyl)-2-propan-2-ylimidazolidin-4-one
CID 83244060
3-[(1-methylpiperidin-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83248207
3-[(1-ethylpiperidin-4-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83252942
2-propan-2-yl-5-propyl-3-(thian-2-ylmethyl)imidazolidin-4-one
CID 83270758
3-(3-methylbutyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83238566
3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 102915982
3-(1-cyclopropylethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83243853
2-methyl-3-[(3-methylcyclohexyl)methyl]-5-propylimidazolidin-4-one
CID 114129936
5-ethyl-3-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylimidazolidin-4-one
CID 83255713
5-butyl-3-[(1-ethylpyrrolidin-2-yl)methyl]-2-propan-2-ylimidazolidin-4-one
CID 83244959
3-methyl-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83260226
3-(2-methylsulfonylethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83256782

Frequently Asked Questions

What is the IUPAC name of 3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one?
The IUPAC name of 3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one (CID 83243576) is 3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one.
What is the SMILES notation for 3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one?
The canonical SMILES for 3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one is CCCC1NC(C(C)C)N(CC2CCC2)C1=O.
What is the InChIKey of 3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one?
The InChIKey is POKMVPWNESDVPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-4-6-12-14(17)16(9-11-7-5-8-11)13(15-12)10(2)3/h10-13,15H,4-9H2,1-3H3.
What are the key properties of 3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one?
3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one has a molecular weight of 238.37 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one is sourced from PubChem (CID 83243576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).