1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one

C19H23N3O — CID 134791093

IUPAC1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(Cc2cccc3ccccc23)CC1
InChIInChI=1S/C19H23N3O/c23-19-20-10-13-22(19)17-8-11-21(12-9-17)14-16-6-3-5-15-4-1-2-7-18(15)16/h1-7,17H,8-14H2,(H,20,23)
InChIKeyCDMLQSFQOKCMSV-UHFFFAOYSA-N
MW309.41 g/mol
LogP2.83
Rot. Bonds3

About 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one

1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one (PubChem CID 134791093) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one
PubChem CID134791093
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC Name1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(Cc2cccc3ccccc23)CC1
InChIInChI=1S/C19H23N3O/c23-19-20-10-13-22(19)17-8-11-21(12-9-17)14-16-6-3-5-15-4-1-2-7-18(15)16/h1-7,17H,8-14H2,(H,20,23)
InChIKeyCDMLQSFQOKCMSV-UHFFFAOYSA-N
XLogP2.83
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one (CID 134791093) is 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one is O=C1NCCN1C1CCN(Cc2cccc3ccccc23)CC1.
What is the InChIKey of 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one?
The InChIKey is CDMLQSFQOKCMSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O/c23-19-20-10-13-22(19)17-8-11-21(12-9-17)14-16-6-3-5-15-4-1-2-7-18(15)16/h1-7,17H,8-14H2,(H,20,23).
What are the key properties of 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one?
1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one has a molecular weight of 309.41 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 134791093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).